- InChI
- InChI=1S/C4H3ClO2S2/c5-9(6,7)4-2-1-3-8-4/h1-3H
- InChI Key
- VNNLHYZDXIBHKZ-UHFFFAOYSA-N
- Formula
- C4H3ClO2S2
- SMILES
- O=S(=O)(Cl)c1cccs1
- Molecular Weight1
- 182.65
- CAS
- 16629-19-9
- Other Names
-
- 2-Thienylsulfonyl chloride
- Thiophene-2-sulfonyl chloride
- thiophene-2-sulphonyl chloride
- ω : Acentric Factor.
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- ΔfH°gas : Enthalpy of formation 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 | 0.4080 | Relay (1.0) Calculated Property | |
| ΔfG° | -170.54 | kJ/mol | Relay (1.0-beta) Calculated Property |
| ΔfH°gas | -229.56 | kJ/mol | Relay (1.0) Calculated Property |
| ΔvapH° | 64.17 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -2.86 | Relay (1.0) Calculated Property | |
| logPoct/wat | 1.676 | Crippen Calculated Property | |
| McVol | 104.440 | ml/mol | McGowan Calculated Property |
| Pc | 4681.15 | kPa | Relay (1.0-beta) Calculated Property |
| Tboil | 511.85 | K | Relay (1.0) Calculated Property |
| Tc | 785.01 | K | Relay (1.0) Calculated Property |
| Tfus | 322.48 | K | Relay (1.0) Calculated Property |
| Vc | 0.357 | m3/kmol | Relay (1.0) Calculated Property |
Similar Compounds
Find more compounds similar to 2-Thiophenesulfonyl chloride.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- McGowan Method
- NIST Webbook
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