p-Trifluoromethylbenzoyl chloride
Structural formula
| Business number | 048K |
|---|---|
| Molecular formula | C8H4Cl3O |
| Molecular weight | 208.57 |
| label |
4-Trifluoromethylbenzoyl chloride, 4-Trifluoromethylbenzoyl chloride, 4-(Trifluoromethyl)formyl chloride, p-Trifluoromethylbenzoyl chloride, P-TRIFLUOROMETHYLBENZOYL CHLORIDE, PTF-BOC, TIMTEC-BB SBB003467, 4-(trifluoromethyl)-benzoylchlorid, Benzoyl chloride, 4-(trifluoromethyl)-, p-Toluoyl chloride, alpha,alpha,alpha-trifluoro-, p-Trifluoromethyl benzoic acid chloride, 4-(TRIFLUOROMETHYL)BENZOYL CHL |
Numbering system
CAS number:329-15-7
MDL number:MFCD00000694
EINECS number:206-342-9
RTECS number:None
BRN number:391282
PubChem ID:None
Physical property data
一 , physical property data
Traits ：Colorless or yellow liquid
Density (g/mL,25/4℃): 1.404
Relative Vapor density (g/mL, air=1)：Not available
Melting point (ºC): -3
Boiling point (ºC, normal pressure): 188-190
Boiling point (ºC, 5.2kPa): Not available
Refraction Rate: 1.467
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 Sex: 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: 41.47
2. Molar volume (m3/mol）：149.3
3. isotonic specific volume (90.2K):348.3
4. Surface Tension (dyne/cm):29.5
5. Polarizability（10-24cm3):16.44
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: 4
4. Number of rotatable chemical bonds: 1
5. Number of tautomers: none
6. Topological molecule polar surface area 17.1
7. Number of heavy atoms: 13
8. Surface charge: 0
9. Complexity: 194
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