p’-DDD – BDMAEE

O,P’-DidiO,P’-DDD

Published by BDMAEE on 2023-12-28 | Permalink

Structural formula

Business number	015X
Molecular formula	C14H10Cl4
Molecular weight	320.04
label	1-Chloro-2-[2,2-dichloro-1-(4-chlorophenyl)ethyl]benzene, O,P’-TDE, 1-Chloro-2-[2,2-dichloro-1-(4-chlorophenyl)ethyl]benzene, Organochlorine pesticides

Numbering system

CAS number:53-19-0

MDL number:MFCD00000850

EINECS number:200-166-6

RTECS number:KH7880000

BRN number:2056007

PubChem number:24855696

Physical property data

1. Character: Crystal.

2. Density (g/mL,25/4℃): Undetermined

3. Relative vapor density (g/mL,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. Flashpoint (ºC): Undetermined

9. Specific optical rotation (º): Undetermined

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

11. Vapor pressure (kPa,25ºC): UndeterminedWater) distribution Log value of coefficient: Undetermined

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

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

19. Solubility: Solution In ethanol, isooctane, carbon tetrachloride.

Toxicological data

None

Ecological data

None

Molecular structure data

1. Molar refractive index: 79.65

2. Molar volume (m³/mol）：233.1

3. isotonic ratio(90.2K)：602.7

4. Surface Tension(dyne/cm)：44.6

5. Polarizability(10-24cm³)：31.57

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 6.2

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 0

4. Number of rotatable chemical bonds: 3

5. Number of tautomers: none

6. Topological molecule polar surface area 0

7. Number of heavy atoms: 18

8. Surface charge: 0

9. Complexity: 248

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: 1

Properties and stability

None

Storage method

Sealed and protected from light , Store in a dry place

Synthesis method

Generally produced from o-bromochlorobenzene.

Purpose

It is used to treat adrenocortical cancer and its migratory cancer, and can also be used to treat increased cortisol caused by adrenal hyperplasia or tumors. Symptom.

so-ascii-font-family: Arial; mso-hansi-font-family: Arial; mso-bidi-font-family: Arial”>):233.1

3. isotonic ratio(90.2K)：602.7

4. Surface Tension(dyne/cm)：44.6

5. Polarizability(10-24cm³)：31.57

Compute chemical data

1. Reference value for hydrophobic parameter calculation (XlogP): 6.2

2. Number of hydrogen bond donors: 0

3. Number of hydrogen bond acceptors: 0

4. Number of rotatable chemical bonds: 3

5. Number of tautomers: none

6. Topological molecule polar surface area 0

7. Number of heavy atoms: 18

8. Surface charge: 0

9. Complexity: 248

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: 1

Properties and stability

None

Storage method

Sealed and protected from light , Store in a dry place

Synthesis method

Generally produced from o-bromochlorobenzene.

Purpose

It is used to treat adrenocortical cancer and its migratory cancer, and can also be used to treat increased cortisol caused by adrenal hyperplasia or tumors. Symptom.

p,p’-Didip,p’-DDD

Published by BDMAEE on 2023-12-25 | Permalink

Structural formula

Business number	01H3
Molecular formula	C14H10Cl4
Molecular weight	320.04
label	4,4-Didi Didi, 1,1-Dichloro-2,2-bis(p-chlorophenyl)ethane, 2,2-bis(4-chlorophenyl)-1,1-dichloroethane, 1,1-Dichloro-2,2-bis(p-chlorophenyl)ethane, p,p’-TDE, 2,2-Bis(4-chlorophenyl)-1,1-dichloroethane, Organochlorine pesticides

Numbering system

CAS number:72-54-8

MDL number:MFCD00000851

EINECS number:200-783-0

RTECS number:KI0700000

BRN number:1914072

PubChem number:24891742

Physical property data

1. Character: white crystal

2. Density (g/mL, 25/4℃): Uncertain

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

4. Melting point (ºC): 94-96

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

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

7. Refractive index: Uncertain

8. Flash point (ºC): 11

9. Specific rotation (º): Uncertain

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

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

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

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

14. Critical Temperature (ºC): Uncertain

15. Critical pressure (KPa): Uncertain

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

16. p>

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

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

19. Dissolution Properties: Soluble in ethanol and carbon tetrachloride

Toxicological data

Acute toxicity: Rat oral LD50: 113 mg/kg; Mouse oral LDLo: 600 mg/kg; Rabbit Administration onto the skin LD50: 1200 mg/kg; Hamster oral LD50: >5 mg/kg; Oncogenic : Rat oral TDLo: 54 gm/kg/78W-C; Mouse oral TDLo: 39 gm/kg/2Y-C;

Mutagenicity: Mouse embryo morphological transformation test system: 28400 nmol/L; Mouse Serratia marcescens host-mediated test system: 1500 mg/kg;

Ecological data

None

Molecular structure data

1. Molar refractive index: 79.65

2. Molar refractive index: 79.65

2.Volume (cm³/mol): 233.1

3. Isotonic volume (90.2K): 465.2

4. Surface tension (dyne/cm) : 44.6

5. Polarizability (10-24cm3): 31.57

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: 3

5. Number of tautomers: none

6. Topological molecule polar surface area 0

7. Number of heavy atoms: 18

8. Surface charge: 0

9. Complexity: 218

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

None

Storage method

This product should be stored in a sealed, cool, dry and dark place.

Synthesis method

Prepared from o-bromochlorobenzene.

Purpose

Anti-neoplastic drugs used to treat adrenocortical cancer.