- InChI
- InChI=1S/C2H2Cl2OS/c3-1(4)2(5)6/h1H,(H,5,6)
- InChI Key
- FTHIZBAYNLJMRT-UHFFFAOYSA-N
- Formula
- C2H2Cl2OS
- SMILES
- O=C(S)C(Cl)Cl
- Molecular Weight1
- 145.01
- CAS
- 13639-16-2
- Other Names
-
- «alpha»-Dichlorothioacetic acid
- 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° | -159.87 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -195.47 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 41.91 | kJ/mol | Joback Calculated Property |
| log10WS | -1.42 | Crippen Calculated Property | |
| logPoct/wat | 1.247 | Crippen Calculated Property | |
| McVol | 81.440 | ml/mol | McGowan Calculated Property |
| Pc | 5495.11 | kPa | Joback Calculated Property |
| Tboil | 436.31 | K | Joback Calculated Property |
| Tc | 667.56 | K | Joback Calculated Property |
| Tfus | 243.53 | K | Joback Calculated Property |
| Vc | 0.299 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [117.13; 138.14] | J/mol×K | [436.31; 667.56] | 
|
| Cp,gas | 117.13 | J/mol×K | 436.31 | Joback Calculated Property |
| Cp,gas | 121.31 | J/mol×K | 474.85 | Joback Calculated Property |
| Cp,gas | 125.20 | J/mol×K | 513.39 | Joback Calculated Property |
| Cp,gas | 128.82 | J/mol×K | 551.93 | Joback Calculated Property |
| Cp,gas | 132.18 | J/mol×K | 590.48 | Joback Calculated Property |
| Cp,gas | 135.28 | J/mol×K | 629.02 | Joback Calculated Property |
| Cp,gas | 138.14 | J/mol×K | 667.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dichlorothiolacetic acid.
Sources
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