trifluoromethanesulfonamide
Structural formula
| Business number | 04RW |
|---|---|
| Molecular formula | CH2O2NF3S |
| Molecular weight | 149.09 |
| label |
trifluoromethanesulfonamide, trifluoromethanesulfonamide, trifluoromethanethiamin, TRIFLAMIDE, TRIFLUOROMETHANESULFONAMIDE, TRIFLUOROMETHANESULPHONAMIDE, Trifluoromethanesulfonamide,96%, trifluoromethylsulfonamide, Trifluoromethanesulphonamide 98%, Trifluoromethanesulphonamide98%, Trifluoromethanesulphonamide, tech. 96% |
Numbering system
CAS number:421-85-2
MDL number:MFCD00068714
EINECS number:431-270-1
RTECS number:None
BRN number:1812099
PubChem number:24882940
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):120-124
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:40.32
2、 Molar volume（m3/mol)：146.9
3、 Isotonic specific volume (90.2K):357.5
4、 Surface tension（dyne/cm)：35.0
5、 Polarizability(10-24cm3)：15.98
Compute chemical data
1. Reference value for hydrophobic parameter calculation (XlogP): 0.1
2. Number of hydrogen bond donors: 1
3. Number of hydrogen bond acceptors: 6
4. Number of rotatable chemical bonds: 0
5. Number of tautomers: none
6. Topological molecule polar surface area 68.5
7. Number of heavy atoms: 8
8. Surface charge: 0
9. Complexity: 161
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
