Tri-n-butyl orthoformate

Structural formula of tri-n-butyl orthoformate

Structural formula of tri-n-butyl orthoformate

Structural formula

Business number 05ZE
Molecular formula C13H28O3
Molecular weight 232.36
label

Tri-n-butyl orthoformate,

Tributyl orthoformate,

Tri-n-butyl orthoformate, 97%,

ORTHOFORMIC ACID TRIBUTYL ESTER,

ORTHOFORMIC ACID TRI-N-BUTYL ESTER,

1,1’,1’’-[methylidynetris(oxy)]tris-butan,

TNBOF,

TRIBUTOXYMETHANE,

TRIBUTYL ORTHOFORMATE,

TRI-N-BUTYL ORTHOFORMATE,

BUTYL ORTHOFORMATE,

Acetal/ketone/orthoester,

organic oxides

Numbering system

CAS number:588-43-2

MDL number:MFCD00015250

EINECS number:209-618-7

RTECS number:None

BRN number:1752526

PubChem number:24886841

Physical property data

1. Physical property data


1. Boiling point (ºC,Normal pressure): 122-124 °C(lit.)


2. Density:0.872g/mL at 25 °C(lit.


3. Refractive index:n20/D 1.418(lit.)


4. Flash Point (ºC):89

Toxicological data

None

Ecological data

3. Ecological data:


1, other harmful effects: This substance may be harmful to the environment, special attention should be paid to water bodies.

Molecular structure data

Molecular property data:

1, Molar refractive index:67.47


2, Molar volume (m3/mol):262.5


3, Isotonic specific volume (90.2K ):605.7


4, Surface tension (dyne/ cm):28.3


5 Polarizability (10-24cm3): 26.74

Calculate chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 3.8

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 12

5. Number of tautomers: none

6. Topological molecule polar surface area 27.7

7. Number of heavy atoms: 16

8. Surface charge: 0

9. Complexity: 105

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

Stability and reactivity:


Materials to avoid: Oxides.


Products to be decomposed: carbon monoxide and carbon dioxide.

Storage method

Storage:


Seal the secret container and store it in a sealed main container in a cool place Dry position.

Synthesis method

None

Purpose

None

Geranylacetone

Geranylacetone structural formula

Geranylacetone structural formula

Structural formula

Business number 079C
Molecular formula C13H22O
Molecular weight 194.31
label

6,10-dimethyl-5,9-undecadien-2-one,

α,β-dihydropseudoionone,

6,10-Dimethyl-5,9-undecadien-2-one,

α,β-Dihydropseudoionone,

Raw materials for the synthesis of nerolithyl alcohol,

Synthetic vitamin E raw materials

Numbering system

CAS number:689-67-8

MDL number:MFCD00008910

EINECS number:223-269-8

RTECS number:YQ1190000

BRN number:1722277

PubChem number:24872324

Physical property data

1. Characteristics: Undetermined.

2. Density (g/mL, 25/4℃): 0.8748

3. Relative vapor density (g/mL, air=1): Undetermined

4. Melting point (ºC): Undetermined 5. Boiling point (ºC, normal pressure): 105

6. Boiling point (ºC, 5.2kPa): Undetermined

7. Refractive index: 1.467

p>

8. Flash point (ºC): >110

9. Specific rotation (º): Undetermined

10. Autoignition point or ignition temperature (ºC ): Undetermined

11. Vapor pressure (kPa, 25ºC): Undetermined

12. Saturated vapor pressure (kPa, 60ºC): Undetermined

13. Heat of combustion (KJ/mol): Undetermined

14. Critical temperature (ºC): Undetermined

15. Critical pressure (KPa): Undetermined

16. The logarithmic value of the oil-water (octanol/water) partition coefficient: Undetermined

17. The upper limit of explosion (%, V/V): Undetermined

18. Lower explosion limit (%, V/V): Not determined

19. Solubility: Not determined.

Toxicological data

1. Acute toxicity: Rat (orally) LD50: >5 mg/kg Rabbit (skin) LD50: >5 mg/kg

Since the LD50 of table salt is 3,000 mg/kg, the acute toxicity of BPA is the same as that of table salt.

Ecological data

Generally not hazardous to water, do not discharge material into the surrounding environment without government permission.

Molecular structure data

1. Molar refractive index: 62.10

2. Molar volume (cm3/mol): 227.0

3. Isotonic specific volume (90.2K ): 521.2

4. Surface tension (dyne/cm): 27.7

5. Dielectric constant:

6. DipoleDistance (10-24cm3):

7. Polarizability: 24.62

Compute chemical data

1. Hydrophobic parameter calculation reference value (XlogP): 3.7

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 1

4. Number of rotatable chemical bonds: 6

5. Topological molecular polar surface area (TPSA): 17.1

6. Number of heavy atoms: 14

7. Surface charge: 0

8. Complexity: 230

9. Number of isotope atoms: 0

10. Determine the number of atomic stereocenters : 0

11. Uncertain number of atomic stereocenters: 0

12. Determined number of chemical bond stereocenters: 0

13. Uncertain chemical bond formation Number of structural centers: 0

14. Number of covalent bond units: 1

Properties and stability

1. Stable under normal temperature and pressure, away from oxides.

2. Exist in smoke.

Storage method

Store in an airtight container in a cool, dry place. Store away from oxidizing agents.

Synthesis method

Obtained from linalool and ethyl acetoacetate under the catalysis of aluminum isopropoxide.

Purpose

1. Mainly used to synthesize nerol, which can further synthesize vitamin E.

2. An important intermediate for the synthesis of isophytoalcohol, which can be prepared into geranium oil and used in the fragrance industry.

1,4-dimethylnaphthalene

1,4-dimethylnaphthalene structural formula

1,4-dimethylnaphthalene structural formula

Structural formula

Business number 05U2
Molecular formula C12H12
Molecular weight 156.22
label

aromatic compounds

Numbering system

CAS number:571-58-4

MDL number:MFCD00004037

EINECS number:209-335-9

RTECS number:None

BRN number:2039842

PubChem number:24863584

Physical property data

1. Physical property data

1. Density (g/mL, 25/4℃): 1.0166

2. Refractive index (nD20 ): 1.6136

3. Flash point (℃): >100

4. Melting point (℃): 7.66

5. Boiling point (ºC, 751 mmHg ): 267.3

6. Relative density (20℃, 4℃): 1.0167

7. Refractive index at room temperature (n25): 1.6114

p>

8. Liquid phase standard hot melt (J·mol-1·K-1): 288.4

Toxicological data

None

Ecological data

None

Molecular structure data

5. Molecular property data:

1. Molar refractive index: 53.74

2. Molar volume (cm3/mol): 156.0

3. Isotonic specific volume (90.2K): 386.3

4. Surface tension (dyne/cm): 37.5

5. Polarizability (10-24cm3): 21.30

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 0

4. Number of rotatable chemical bonds: 0

5. Number of tautomers: none

6. Topological molecule polar surface area 0

7. Number of heavy atoms: 12

8. Surface charge: 0

9. Complexity: 132

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

1. Exists in oriental tobacco leaves and smoke.

Storage method

None

Synthesis method

1. Tobacco: OR, 57.

Purpose

None

Orchidosequinone

Structural formula of lanxuequinone

Structural formula of lanxuequinone

Structural formula

Business number 0528
Molecular formula C11H8O3
Molecular weight 188.10
label

5-Hydroxy-2-methyl-1,4-naphthoquinone

Numbering system

CAS number:481-42-5

MDL number:MFCD00001682

EINECS number:207-569-6

RTECS number:QL8500000

BRN number:None

PubChem number:24898833

Physical property data

1. Character: Undetermined


2. Density (g/ m3,25/4): Undetermined


3. Relative vapor density ( g/cm3,Air=1): Undetermined


4. Melting point (ºC):76-78


5. Boiling point (ºC,Normal pressure): Undetermined


6. Boiling point (ºC,5.2kPa): Undetermined


7. Refractive index: Undetermined


8. Flash Point (ºC): Undetermined


9. Specific optical rotation (º): Undetermined


10. Autoignition point or ignition temperature (ºC): Undetermined


11. Vapor pressure (kPa,25ºC): Undetermined


12. Saturated vapor pressure (kPa,60ºC): Undetermined


13. Heat of combustion (KJ/mol): Undetermined


14. Critical temperature (ºC): Undetermined


15. Critical pressure (KPa): Undetermined


16. Oil and water (octanol/Log value of water) partition coefficient: Undetermined


17. Explosion limit (%,V/V): Undetermined


18. Lower explosion limit (%,V/V): Undetermined


19. Solubility: Undetermined

Toxicological data

1 , Acute toxicity: Rat oral administrationLD50: 65mg/kg, no details except lethal dose;


Orally administered to miceLD50: 16ug/kg, no details except lethal dose;


Mouse transperitoneallyLD50: 5mg/kg, no details except lethal dose;


2, reproductive toxicity: ratDOSEoralTDLo: female Pregnant 10 Queen: 300mg/kgSEX/DURATION, produced in the mother’s ovaries and fallopian tubes Impact.


RatDOSEOralTDLo: Female pregnancy30 Queen of Heaven:100mg/kgSEX/DURATION, which has an impact on mating performance.


Rat DOSEOral TDLo: Female pregnant 15 days later: 150mg/kgSEX/ DURATION, affects the mother’s delivery.


Rat DOSEOral TDLo: Female pregnant 5-11 days later: 35mg/ kgSEX/DURATION, causing miscarriage.


Rat DOSEOral TDLo: Female pregnancy 1-5 days later: 50mg/ kgSEX/DURATION, affects preimplantation mortality;


dogDOSE Transabdominal TDLo: Male 30 days before mating: 300mg/kgSEX/ DURATION, affecting the father’s testicles, epididymis, and sperm ducts;


RabbitDOSE Oral TDLo: Female 1 days before mating: 10mg/kgSEX/ DURATION, affecting fertility.


3 , Mutagenicity data: MicroorganismsTEST Systematic mutation: bacteria TyphimuriumSalmonella:100 ug/plate;


Microbial organisms TESTSystem mutation: Escherichia coli:500umol/plate.

Ecological data

This substance may be harmful to the environment, and special attention should be paid to water bodies.

Molecular structure data

1 Molar refractive index:49.48


2 Molar volumem3/mol)138.9


3 , Isotonic specific volume (90.2K):382.0


4 Surface tensiondyne/cm)57.1


5 Polarizability(10-24cm319.61

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 0

5. Number of tautomers: 14

6. Topological molecule polar surface area 54.4

7. Number of heavy atoms: 14

8. Surface charge: 0

9. Complexity: 317

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

Use and store according to specifications, no decomposition will occur, and avoid contact with oxides

Storage method

Temperature-20Store at ℃

Synthesis method

None

Purpose

None

3-Nitrophenylhydrazine hydrochloride

3-Nitrophenylhydrazine Hydrochloride Structural Formula

3-Nitrophenylhydrazine Hydrochloride Structural Formula

Structural formula

Business number 070A
Molecular formula C6H8ClN3O2
Molecular weight 189.60
label

3-Nitrophenylhydrazine hydrochloride,

O2NC6H4NHNH2·HCl,

Salt

Numbering system

CAS number:636-95-3

MDL number:MFCD00012939

EINECS number:211-270-6

RTECS number:None

BRN number:3569013

PubChem number:24897354

Physical property data

1. Characteristics: yellow lens powder.


2. Density (g/mL,25/4): Undetermined


3. Relative vapor density (g/mL,AIR=1): Undetermined


4. Melting point (ºC): 210


5. Boiling point (ºC,Normal pressure): Undetermined


6. Boiling point (ºC,5.2kPa): Undetermined


7. Refractive Index: Undetermined


8. Flash Point (ºC): Undetermined


9. Specific optical rotation (º): Undetermined


10. Autoignition point or ignition temperature (ºC): Undetermined


11. Vapor pressure (kPa,25ºC): Undetermined


12. Saturated vapor pressure (kPa,60ºC): Undetermined


13. Heat of combustion (KJ/mol): Undetermined


14. Critical temperature (ºC): Undetermined


15. Critical pressure (KPa): Undetermined


16. Oil and water (octanol/Log value of the partition coefficient of water: undetermined


17. Explosion limit (%,V/V): Undetermined


18. Lower explosion limit (%,V/V): Undetermined


19. Solubility: soluble in water.

Toxicological data

None

Ecological data

If it is slightly harmful to water, do not Allow undiluted or large amounts of product to come into contact with groundwater, waterways or sewage systems. Do not discharge materials into the surrounding environment without government permission.

Molecular structure data

1. Molar refractive index: 41.31


2. Molar volume (m3/mol):107.9


3. Isotonic specific volume (90.2K):310.8


4. Surface Tension (dyne/cm):68.9


5. Polarizability10-24cm3):16.37

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 3

3. Number of hydrogen bond acceptors: 4

4. Number of rotatable chemical bonds: 1

5. Number of tautomers: none

6. Topological molecule polar surface area 83.9

7. Number of heavy atoms: 12

8. Surface charge: 0

9. Complexity: 145

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 2

Properties and stability

Keep away from oxides.

Storage method

Stored in Seal the container and place in a cool, dry place. Store away from oxidizing agents.

Synthesis method

None

Purpose

Apply to pharmaceutical intermediates.

α-D-glucose pentaacetate

α-D-glucose pentaacetate structural formula

α-D-glucose pentaacetate structural formula

Structural formula

Business number 068D
Molecular formula C16H22O11
Molecular weight 390.34
label

Glucose Pentaacetate,

1,2,3,4,6-O-pentacetyl-α-D-glucose,

1,2,3,4,6-Penta-O-acetyl-α-D-glucopyranose

Numbering system

CAS number:604-68-2

MDL number:MFCD00064071

EINECS number:210-073-2

RTECS number:None

BRN number:98852

PubChem number:24895094

Physical property data

Physical property data;
1. Melting point (): 125-128

2. Solubility:Insoluble in water, easily soluble in organic solvents such as ether, acetone, chloroform, ethyl acetate

Toxicological data

None

Ecological data

3. Ecological data:


1. Other harmful effects: This substance may be harmful to the environment and should be harmful to water bodies. Give special attention.

Molecular structure data


5. Molecular property data:


1, Molar refractive index:85.00


2, Molar volume (m3/mol):298.0


3, Isotonic specific volume (90.2K):779.0


4, Surface tension (dyne/cm):46.7


5, Polarizability (10-24cm3 ):33.69

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 11

4. Number of rotatable chemical bonds: 11

5. Number of tautomers: none

6. Topological molecule polar surface area 141

7. Number of heavy atoms: 27

8. Surface charge: 0

9. Complexity: 599

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 5

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

Properties and stability:


No decomposition products may occur under normal temperatures and pressures.

Storage method

Storage:


Seal the secret container and store it in a sealed main container in a cool place Dry position.

Synthesis method

1. Introduction to production methods


Prepared from glucose through acetylation reaction.


Purpose

2. Purpose


It is an important intermediate for the synthesis of glycosides and oligosaccharides.

methacholine bromide

Methacholine bromide structural formula

Methacholine bromide structural formula

Structural formula

Business number 049J
Molecular formula C8H18BrNO2
Molecular weight 240.15
label

2-(acetoxy)-N,N,N-trimethyl-1-propyl ammonium bromide,

Acetyl-beta-methylcholine bromide,

methacholine bromide,

methacholine bromide,

Acetyl-beta-methylcholine bromide,

Acetyl-beta-methylcholine bromide (2-HYDROXYPROPYL),

1-Propanaminium,2-(acetyloxy)-N,N,N-trimethyl-bromide,

2-(acetyloxy)-N,N,N-trimethyl-1-propanaminiubromide,

Mecholyl bromide,

Trimethyl-β-acetoxypropylammonium bromide

Numbering system

CAS number:333-31-3

MDL number:MFCD00011816

EINECS number:206-372-2

RTECS number:None

BRN number:6098010

PubChem number:24890626

Physical property data

1. Physical property data

Characteristics: white crystal, hygroscopic.

Density (g/mL, 25/4℃): Not available

Relative vapor density (g/mL, air=1) : Not available

Melting point (ºC): 147-149

Boiling point (ºC, normal pressure): Not available

Boiling point (ºC, 5.2kPa): Not available

Refractive index: Not available

Flash point (ºC ): Not available

Specific rotation (º): Not available

Autoignition point or ignition temperature (ºC): Not available

Vapor pressure (kPa, 25ºC): Not available

Saturated vapor pressure (kPa, 60ºC): Not available

Heat of combustion (KJ/mol): Not available

Critical temperature (ºC): Not available

Critical pressure (KPa): Not available

Log value of oil-water (octanol/water) partition coefficient: Not available

Explosion upper limit (%, V/V): Not available

Lower explosion limit (%, V/V): Not available

Solubility: Easily soluble in water , ethanol and glycerol.

Toxicological data

2. Toxicological data:

Acute toxicity: Not available.

Ecological data

3. Ecological data:

1. Other harmful effects: This substance may be harmful to the environment, and special attention should be paid to water bodies.

Molecular structure data

None

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 3

4.Number of rotatable chemical bonds: 4

5. Number of tautomers: None

6. Topological molecule polar surface area 26.3

7. Number of heavy atoms :12

8. Surface charge: 0

9. Complexity: 138

10. Number of isotope atoms: 0

11 .Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 1

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 2

Properties and stability

1. Irritating.

Storage method

Seal and store in dry condition at -0℃.

Synthesis method

None

Purpose

Biochemical research.

Juglone

Juglone structural formula

Juglone structural formula

Structural formula

Business number 0527
Molecular formula C10H6O3
Molecular weight 174.16
label

5-hydroxy-1,4-naphthoquinone,

5-hydroxy-1,4-naphthoquinone,

Juglone,

1,4-Naphthalenedione, 5-hydroxy-,

5-Hydroxy-1,4-naphthoquinone,

5-Hydroxy-1,4-naphthalenedione,

Juglone

Numbering system

CAS number:481-39-0

MDL number:MFCD00001684

EINECS number:207-567-5

RTECS number:QJ5775000

BRN number:1909764

PubChem ID:None

Physical property data

1. Properties: yellow needle-like crystals

2. Density (g/m3, 25/4℃): Undetermined

3 . Relative vapor density (g/cm3, air=1): Undetermined

4. Melting point (ºC): 161-163

5. Boiling point (ºC, normal pressure): 250

6. Boiling point (ºC, 5.2kPa): Undetermined

7. Refractive index: Undetermined

8 . Flash point (ºC): Not determined

9. Specific rotation (º): Undetermined

10. Autoignition point or ignition temperature (ºC): Not determined

p>

11. Vapor pressure (kPa, 25ºC): Undetermined

12. Saturated vapor pressure (kPa, 60ºC): Undetermined

13. Heat of combustion (KJ /mol): Undetermined

14. Critical temperature (ºC): Undetermined

15. Critical pressure (KPa): Undetermined

16. Oil and water Log value of the (octanol/water) partition coefficient: Undetermined

17. Explosion upper limit (%, V/V): Undetermined

18. Explosion lower limit (%, V /V): Undetermined

19. Solubility: Dissolved in hot water

Toxicological data

1. Acute toxicity: Rat oral LD50: 112mg/kg, no detailed description except lethal dose;

Mouse oral LD50: 2500ug/kg, behavior – lethargy (ordinary depressive activity) );

Mouse intraperitoneal LD50: 25 mg/kg, no detailed instructions except the lethal dose;

Dog intravenous LD50: 10 mg/kg, no detailed instructions except the lethal dose ;

2. Oncogenicity data: Mouse transdermal TDLo: 394 mg/kg/53W-I, tumor-tumor RTECS standard, skin and appendages-tumor

3. Mutagenicity data: Microorganism TEST system mutations: Bacteria – Salmonella typhimurium: 30 ug/plate;

Loss and non-disjunction of sex chromosomes: OralTEST system: Insects – Drosophila: 10 pph;

Mutation testing system – not other specifiedTEST systems��Rodent-mouse ascites: 10 mg/kg.

Ecological data

General remarks

Water hazard level 1 (German regulations) (self-assessment via list) This substance is slightly hazardous to water.

Do not allow undiluted or large amounts of product to come into contact with groundwater, waterways or sewage systems.

Do not discharge materials into the surrounding environment without government permission.

Molecular structure data

1. Molar refractive index: 44.78

2. Molar volume (cm3/mol): 120.9

3. Isotonic specific volume (90.2K ): 345.7

4. Surface tension (dyne/cm): 66.7

5. Polarizability (10-24cm3): 17.75

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 1

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 0

5. Number of tautomers: 5

6. Topological molecule polar surface area 54.4

7. Number of heavy atoms: 13

8. Surface charge: 0

9. Complexity: 280

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. Uncertain number of atomic stereocenters: 0

13. Determine the number of chemical bond stereocenters: 0

14. Number of uncertain chemical bond stereocenters: 0

15. Number of covalent bond units: 1

Properties and stability

Use and store according to specifications, no decomposition will occur, and avoid contact with oxides

Storage method

Seal and store in a ventilated, dry place to avoid contact with other oxides.

Synthesis method

Juglone, as the glycoside of hydrogenated juglone (trihydroxynaphthalene), is found in the immature exocarp (green peel) of Juglans juglans and its congener, Black walnut. It can be isolated from natural substances or chemically synthesized.

Purpose

Juglone has hemostatic and antimicrobial activity and has also been used to treat eczema, psoriasis, and tinea pedis. Used as pH indicator agent.

Cadmium carbonate

Cadmium carbonate structural formula

Structural formula

Business number 05AX
Molecular formula CdCO3
Molecular weight 172.42
label

flux,

catalyst,

stabilizer,

Plasticizer

Numbering system

CAS number:513-78-0

MDL number:MFCD00010918

EINECS number:208-168-9

RTECS number:FF9320000

BRN number:None

PubChem number:24853282

Physical property data

1. Properties: Trigonal crystal system, white powder.

2. Density (g/ cm3, 25/4℃): 4.258

3. Relative steam density (g/cm3 , air=1): Undetermined

4. Melting point (ºC): 500

5. Boiling point (ºC, normal pressure): Undetermined

6. Boiling point (ºC, 8kPa): Undetermined

7. Refractive index: Undetermined

8. Flash point (ºF): Undetermined

9. Specific optical rotation (º): Undetermined

10. Autoignition point or ignition temperature (ºC): Undetermined

11. Vapor pressure (kPa, 25ºC) : Undetermined

12. Saturated vapor pressure (kPa, 60ºC): Undetermined

13. Heat of combustion (KJ/mol): Undetermined

14 . Critical temperature (ºC): Undetermined

15. Critical pressure (KPa): Undetermined

16. Log value of oil-water (octanol/water) partition coefficient: Undetermined

17. Explosion upper limit (%, V/V): Undetermined

18. Explosion lower limit (%, V/V): Undetermined

19 . Solubility: Insoluble in water and organic solvents, soluble in acid, potassium cyanide, and ammonium salts.

Toxicological data

1. Cadmium compounds with low solubility first act on the respiratory organs and gastrointestinal tract. The absorption effects are manifested as damage to the central nervous system and peripheral nervous system, internal organs, mainly the heart, kidney, liver, skeletal muscle and bone tissue. . Acute poisoning by cadmium oxide dust can cause irritation symptoms of the upper respiratory tract and deep respiratory mucosa, such as sweet taste in the mouth, forehead pain, dizziness, weakness, nausea, and upper abdominal pain. Symptoms of chronic poisoning are reduced sense of smell, headache, and weight loss.

Ecological data

This substance may be harmful to the environment, and special attention should be paid to water bodies.

Molecular structure data

None

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): None

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 3

4. Number of rotatable chemical bonds: 0

5. TautovarianceNumber of solids: None

6. Topological molecule polar surface area 63.2

7. Number of heavy atoms: 5

8. Surface charge: 0

9. Complexity: 18.8

10. Number of isotope atoms: 0

11. Determine the number of atomic stereocenters: 0

12. The number of uncertain stereocenters of atoms: 0

13. The number of determined stereocenters of chemical bonds: 0

14. The number of uncertain stereocenters of chemical bonds: 0

15. Number of covalent bond units: 2

Properties and stability

1. At 310℃, its color changes, from white to yellow, and then to brown. When burned to 500°C, CO2 is released and converted into cadmium oxide. Dry or wet cadmium carbonate is stable in the air and does not decompose when boiled in water for a long time. When irradiated with light with a wavelength of 300 to 400 nm, ultraviolet fluorescence occurs. It reacts with hydrogen at room temperature and is instantly reduced to metal. It reacts with liquid sulfur at 200~300℃ to generate cadmium sulfide and release sulfur dioxide and carbon dioxide. Solubility: 2.8μg/100g H2O, soluble in acid, ammonia and cyanide solution, density: 4.25g/cm3, stable at room temperature.

2.Very poisonous! Cadmium compounds with low solubility first act on the respiratory organs and gastrointestinal tract, and are absorbed into the central nervous system, peripheral nervous system, and internal organs. Mainly damage to heart, liver, kidney, skeletal muscle and bone tissue. Acute poisoning by cadmium dust can cause irritation symptoms of the upper respiratory tract and deep respiratory mucosa, such as sweet taste in the mouth, forehead pain, dizziness, weakness, nausea, and upper abdominal pain. For other poisoning symptoms, see Cadmium Oxide. p>

Storage method

1. Store in a cool, dry and well-ventilated warehouse.

2. Keep away from fire and heat sources. Protect from direct sunlight. The packaging is sealed.

3. They should be stored separately from acids and food chemicals, and avoid mixed storage. Suitable materials should be available in the storage area to contain spills.

Synthesis method

1. Cadmium nitrate method: Cadmium ingot reacts with nitric acid to generate cadmium nitrate, and then reacts with soda ash to generate cadmium carbonate. It is then washed, dried and crushed to obtain the finished cadmium carbonate. Its response equations:

2. Hydrochloric acid method: melt the cadmium ingot, pour it into water and crush it into granules, add hydrochloric acid to dissolve it to form cadmium chloride, and at the same time Add a small amount of nitric acid, add ammonia under stirring to adjust the pH to 5~6, then add a small amount of hydrogen peroxide to remove iron, filter it and react with the prepared soda ash solution to pH 9~10, rinse with water until neutral, then filter and dry at 120°C , to obtain finished cadmium carbonate products. Its reaction equation:

3. Weigh 18g CdCl2 and dissolve it in 50mL water. Then weigh 10g ammonium carbonate and dissolve it in 50mL water. Add the ammonium carbonate solution to the CdCl2 In the solution, after the precipitate is formed, drop in ammonia water to dissolve the formed precipitate. Transfer the solution to a fume hood and heat it in a water bath until the ammonia in the solution volatilizes and crystals settle down.
4.There are mainly two methods for industrial production of cadmium carbonate. Metathesis method: obtained by metathesis of alkali metal carbonates and chromium salts such as cadmium chloride or cadmium sulfate. The source of chromium is mostly metal cadmium as raw material, and can also be used as a by-product of zinc smelting and zinc barium white production. Carbonization method is obtained by absorbing carbon dioxide with cadmium hydroxide. 5.Heat 20% cadmium sulfate aqueous solution to boiling, slowly add 45~ while stirring Use about 20% ammonium carbonate aqueous solution at 50℃ to react with a pH value between 7.5 and 8:Let it stand until the precipitation is complete, filter it, and wash the precipitation several times with 30 to 40 times the volume of hot distilled water. After suction filtration, dry at 120~150℃ for 3 hours to obtain the reagent cadmium carbonate. The preparation of high-purity cadmium carbonate is also carried out according to this principle. The reagents used are high-purity cadmium sulfate, high-purity ammonium carbonate and conductive water.

Purpose

1. Intermediates and insulating materials used in the manufacture of polyester. It is used as a flux for glass pigments, a catalyst for organic reactions, a plasticizer and stabilizer for plastics, and as a raw material for the production of cadmium salts.

2.As an intermediate for manufacturing polyester and a co-solvent for glass pigments, it can be used to make optical glass and be used as insulating materials , catalysts for organic reactions, plasticizers and stabilizers for plastic paper, and raw materials for the production of chromium salts.

3.In surface treatment, prepare soluble cadmium salts for adding cadmium to cadmium electroplating or cadmium alloy electroplating solutions.

Methyl sorbate

Methyl sorbate structural formula

Methyl sorbate structural formula

Structural formula

Business number 079D
Molecular formula C7H10O2
Molecular weight 126.15
label

Methyl hexadienoate,

Methyl sorbate,

CH3CH=CHCH=CHCO2CH3,

aliphatic compounds

Numbering system

CAS number:689-89-4

MDL number:MFCD00038319

EINECS number:211-712-8

RTECS number:None

BRN number:None

PubChem number:24901855

Physical property data

1. Character: Undetermined.


2. Density (g/mL,25/4): 0.968


3. Relative vapor density (g/mL,air=1): Undetermined


4. Melting point (ºC): 15


5. Boiling point (ºC,Normal pressure): 180


6. Boiling point (ºC,5.2kPa): Undetermined


7. Refractive index: 1.503


8. Flash Point (ºC): 70


9. Specific optical rotation (º): Undetermined


10. Autoignition point or ignition temperature (ºC): Undetermined


11. Vapor pressure (kPa,25ºC): Undetermined


12. Saturated vapor pressure (kPa,60ºC): Undetermined


13. Heat of combustion (KJ/mol): 41.63


14. Critical temperature (ºC): Undetermined


15. Critical pressure (KPa): Undetermined


16. Oil and water (octanol/Log value of water) partition coefficient: 1.86


17. Explosion limit (%,V/V): Undetermined


18. Lower explosion limit ( %,V/V): Undetermined


19. Solubility: Undetermined .

Toxicological data

None

Ecological data

Usually not harmful to water, Do not discharge materials into the surrounding environment without government permission.

Molecular structure data


1. Molar refractive index: 36.36


2. Molar volumem3/ mol134.7


3. Isotonic specific volume90.2K309.8


4. Surface Tensiondyne/cm27.9


5. Dielectric constant:


6. Dipole moment10 -24cm3)


7. Polarizability: 14.41


Compute chemical data

1. Hydrophobic parameters Calculate reference value (XlogP): 1.6


2. Hydrogen Bonding Number of donors: 0


3. Hydrogen Bonding Number of receptors: 2


4. Rotatable Number of chemical bonds: 3


5. Topological molecules Polar surface area (TPSA): 26.3


6. Heavy atoms Quantity: 9


7. Surface charge: 0


8. Complexity :134


9. Isotope atomic number:0


10. Determine the number of atomic stereocenters:0


11. Uncertain number of atomic stereocenters:0


12. Determine the number of stereocenters of chemical bonds:0


13. Uncertain number of chemical bond stereocenters:0


14. Number of covalent bond units:1

Properties and stability

Stay away from strong acids, alkalis, and strong oxidants.

Storage method

Store in an airtight container and place Store in a cool, dry place. The storage place must be away from oxidants and open flames.

Synthesis method

None

Purpose

None

BDMAEE:Bis (2-Dimethylaminoethyl) Ether

CAS NO:3033-62-3

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