- InChI
- InChI=1S/C2H3ClO2S/c1-5-2(4)6-3/h1H3
- InChI Key
- TXJXPZVVSLAQOQ-UHFFFAOYSA-N
- Formula
- C2H3ClO2S
- SMILES
- COC(=O)SCl
- Molecular Weight1
- 126.56
- CAS
- 26555-40-8
- Other Names
-
- Carbonothioic acid, anhydrosulfide with thiohypochlorous acid, methyl ester
- thiocarbonic acid, anhydrosulphide with methyl thiohypochlorite
- 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° | -246.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -303.28 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 12.05 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 40.40 | kJ/mol | Joback Calculated Property |
| log10WS | -1.53 | Crippen Calculated Property | |
| logPoct/wat | 1.640 | Crippen Calculated Property | |
| McVol | 75.070 | ml/mol | McGowan Calculated Property |
| Pc | 5220.69 | kPa | Joback Calculated Property |
| Tboil | 427.66 | K | Joback Calculated Property |
| Tc | 644.29 | K | Joback Calculated Property |
| Tfus | 248.78 | K | Joback Calculated Property |
| Vc | 0.275 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [117.15; 141.40] | J/mol×K | [427.66; 644.29] | 
|
| Cp,gas | 117.15 | J/mol×K | 427.66 | Joback Calculated Property |
| Cp,gas | 121.47 | J/mol×K | 463.77 | Joback Calculated Property |
| Cp,gas | 125.70 | J/mol×K | 499.87 | Joback Calculated Property |
| Cp,gas | 129.84 | J/mol×K | 535.98 | Joback Calculated Property |
| Cp,gas | 133.84 | J/mol×K | 572.08 | Joback Calculated Property |
| Cp,gas | 137.70 | J/mol×K | 608.19 | Joback Calculated Property |
| Cp,gas | 141.40 | J/mol×K | 644.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methoxycarbonylsulfenyl chloride.
Sources
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