- InChI
- InChI=1S/C7H4ClNO2S/c8-12(10,11)7-4-2-1-3-6(7)5-9/h1-4H
- InChI Key
- NQAYCMBZPAARNO-UHFFFAOYSA-N
- Formula
- C7H4ClNO2S
- SMILES
- N#Cc1ccccc1S(=O)(=O)Cl
- Molecular Weight1
- 201.63
- CAS
- 69360-26-5
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -236.45 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -266.96 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.62 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.61 | kJ/mol | Joback Calculated Property |
| log10WS | -2.24 | Crippen Calculated Property | |
| logPoct/wat | 1.486 | Crippen Calculated Property | |
| McVol | 127.440 | ml/mol | McGowan Calculated Property |
| Pc | 4559.21 | kPa | Joback Calculated Property |
| Tboil | 578.51 | K | Joback Calculated Property |
| Tc | 810.14 | K | Joback Calculated Property |
| Tfus | 341.06 | K | Joback Calculated Property |
| Vc | 0.520 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [252.92; 295.36] | J/mol×K | [578.51; 810.14] | 
|
| Cp,gas | 252.92 | J/mol×K | 578.51 | Joback Calculated Property |
| Cp,gas | 261.64 | J/mol×K | 617.12 | Joback Calculated Property |
| Cp,gas | 269.69 | J/mol×K | 655.72 | Joback Calculated Property |
| Cp,gas | 277.09 | J/mol×K | 694.33 | Joback Calculated Property |
| Cp,gas | 283.83 | J/mol×K | 732.93 | Joback Calculated Property |
| Cp,gas | 289.92 | J/mol×K | 771.54 | Joback Calculated Property |
| Cp,gas | 295.36 | J/mol×K | 810.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Cyanobenzenesulfonyl chloride.
Sources
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