2-Amino-3-chlorotrifluorotoluene
Structural formula
| Business number | 04TB |
|---|---|
| Molecular formula | C7H5ClF3N |
| Molecular weight | 195.57 |
| label |
2-Amino-3-chlorotrifluorotoluene, 2-AMINO-1-CHLORO-3-TRIFLUOROMETHYLBENZENE, 2-AMINO-3-CHLOROBENZOTRIFLUORIDE, 2-AMINO-3-CHLORO-ALFA,ALFA,ALFA-TRIFLUOROTOLUENE, 2-CHLORO-6-TRIFLUOROMETHYLANILINE |
Numbering system
CAS number:433-94-3
MDL number:MFCD00272565
EINECS number:207-091-8
RTECS number:None
BRN number:None
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): Not available
Boiling point (ºC, normal pressure): Not possibleUse
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 Character: Not allowed��
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:40.36
2、 Molar volume（m3/mol)：137.1
3、 etc. Zhang Biron (90.2K):326.1
4、 Surface tension（dyne/cm)：31.9
5、 Polarizability(10-24cm3）：16.00
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 2.8
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 4
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 26
7. Number of heavy atoms: 12
8. Surface charge: 0
9. Complexity: 159
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 yet
Storage method
None yet
Synthesis method
None yet
Purpose
None yet
