- InChI
- InChI=1S/C4H6S2/c5-4-2-1-3-6-4/h1-3H2
- InChI Key
- SMRSQGJONQYPSA-UHFFFAOYSA-N
- Formula
- C4H6S2
- SMILES
- S=C1CCCS1
- Molecular Weight1
- 118.22
- 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).
- I : Polar retention indices.
- 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° | 157.77 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 115.29 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 8.67 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.35 | kJ/mol | Joback Calculated Property |
| log10WS | -2.13 | Crippen Calculated Property | |
| logPoct/wat | 1.841 | Crippen Calculated Property | |
| McVol | 84.760 | ml/mol | McGowan Calculated Property |
| Pc | 5644.74 | kPa | Joback Calculated Property |
| I | [1720.00; 1720.00] |
|
|
| I | 1720.00 | NIST | |
| I | 1720.00 | NIST | |
| Tboil | 431.34 | K | Joback Calculated Property |
| Tc | 677.47 | K | Joback Calculated Property |
| Tfus | 297.10 | K | Joback Calculated Property |
| Vc | 0.285 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [139.07; 184.47] | J/mol×K | [431.34; 677.47] |
|
| Cp,gas | 139.07 | J/mol×K | 431.34 | Joback Calculated Property |
| Cp,gas | 148.48 | J/mol×K | 472.36 | Joback Calculated Property |
| Cp,gas | 157.05 | J/mol×K | 513.38 | Joback Calculated Property |
| Cp,gas | 164.87 | J/mol×K | 554.41 | Joback Calculated Property |
| Cp,gas | 172.00 | J/mol×K | 595.43 | Joback Calculated Property |
| Cp,gas | 178.51 | J/mol×K | 636.45 | Joback Calculated Property |
| Cp,gas | 184.47 | J/mol×K | 677.47 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dihydro-2(3H)-thiophenthione.
Sources
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