- InChI
- InChI=1S/CClF3O2S/c2-8(6,7)1(3,4)5
- InChI Key
- GRGCWBWNLSTIEN-UHFFFAOYSA-N
- Formula
- CClF3O2S
- SMILES
- O=S(=O)(Cl)C(F)(F)F
- Molecular Weight1
- 168.52
- CAS
- 421-83-0
- Other Names
-
- Methanesulfonyl chloride, trifluoro-
- trifluoromethanesulphonyl chloride
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3442 | Relay (... Calculated Property | |
| ΔfG° | -1104.52 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -950.69 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 15.75 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.09 | kJ/mol | Relay (... Calculated Property |
| IE | 12.41 | eV | Relay (... Calculated Property |
| log10WS | -1.33 | Relay (... Calculated Property | |
| logPoct/wat | 1.075 | Crippen Calculated Property | |
| McVol | 70.590 | ml/mol | McGowan Calculated Property |
| Pc | 5809.41 | kPa | Joback Calculated Property |
| Tboil | 305.50 ± 0.50 | K | NIST |
| Tc | 499.59 | K | Relay (... Calculated Property |
| Tfus | 324.26 | K | Relay (... Calculated Property |
| Vc | 0.273 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [114.79; 139.21] | J/mol×K | [302.07; 455.24] | 
|
| Cp,gas | 114.79 | J/mol×K | 302.07 | Joback Calculated Property |
| Cp,gas | 119.40 | J/mol×K | 327.60 | Joback Calculated Property |
| Cp,gas | 123.80 | J/mol×K | 353.13 | Joback Calculated Property |
| Cp,gas | 127.97 | J/mol×K | 378.66 | Joback Calculated Property |
| Cp,gas | 131.93 | J/mol×K | 404.19 | Joback Calculated Property |
| Cp,gas | 135.67 | J/mol×K | 429.72 | Joback Calculated Property |
| Cp,gas | 139.21 | J/mol×K | 455.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Trifluoromethanesulfonyl chloride.
Sources
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