p-trifluoromethylthiobenzoic acid

Structural formula of p-trifluoromethylthiobenzoic acid

Structural formula of p-trifluoromethylthiobenzoic acid

Structural formula

Business number 048U
Molecular formula C8H5F3O2S
Molecular weight 222.19
label

p-Trifluoromethylthiobenzoic acid,

4-(Trifluoromethylthio)benzoic acid,

4-(Trifluoromethylthio)benzoic acid,

RARECHEM AL BO 0420,

4-TRIFLUOROMETHYLSULFANYL-BENZOIC ACID,

4-(TRIFLUOROMETHYLTHIO)BENZOIC ACID,

4-trifluomethylthio-benzoic acid,

4-(Trifluoromethylthio)benzoic acid 98%,

4-(Trifluoromethylthio)benzoic acid98%,

-(TRIFLUOROMETHYLTHIO)BENZOIC ACID,

p-(Trifluorome

Numbering system

CAS number:330-17-6

MDL number:MFCD00040906

EINECS number:000-000-0

RTECS number:None

BRN number:2693449

PubChem ID:None

Physical property data

一 , physical property data


Traits :Not available


Density (g/mL,25/4): Not available


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


Melting point (ºC): 159.5-162.5


Boiling point (ºC, normal pressure): Not available


Boiling point (ºC, 5.2kPa): Not available


Refraction Rate: Not available


Flash Point (ºC): Not available


Optical rotation (º): Not available


Spontaneous combustion Point or ignition temperature (ºC): Not available


Steam Pressure (kPa, 25ºC): Not available


saturated Vapor pressure (kPa, 60ºC): Not available


Burn Heat (KJ/mol):Not available


Critical Temperature (ºC): Not available


Critical Pressure (KPa): Not available


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


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


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


Dissolve Properties: Not available

Toxicological data

Two , Toxicological data:


Acute Toxicity:Not available .

Ecological data

Three , Ecological data:


1 , Other harmful effects: This substance may be harmful to the environment, and special treatment should be given to water bodies. Notice.

Molecular structure data

1. Molar refractive index: 46.03


2. Molar volume (m3/mol):147.3


3. isotonic specific volume (90.2K):380.2


4. Surface tension (dyne /cm):44.3


5. Polarizability10-24cm3):18.24

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: 6

4. Number of rotatable chemical bonds: 2

5. Number of tautomers: none

6. Topological molecule polar surface area 62.6

7. Number of heavy atoms: 14

8. Surface charge: 0

9. Complexity: 209

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

None

Synthesis method

None

Purpose

None

BDMAEE:Bis (2-Dimethylaminoethyl) Ether

CAS NO:3033-62-3

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