- InChI
- InChI=1S/C4H10S2/c1-6-4-2-3-5/h5H,2-4H2,1H3
- InChI Key
- GLSINCGJNDJREL-UHFFFAOYSA-N
- Formula
- C4H10S2
- SMILES
- CSCCCS
- Molecular Weight1
- 122.25
- 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).
- Inp : Non-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° | 45.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -45.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 14.29 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 38.05 | kJ/mol | Joback Calculated Property |
| log10WS | -1.45 | Crippen Calculated Property | |
| logPoct/wat | 1.669 | Crippen Calculated Property | |
| McVol | 99.920 | ml/mol | McGowan Calculated Property |
| Pc | 4322.57 | kPa | Joback Calculated Property |
| Inp | [1041.00; 1041.00] |
|
|
| Inp | 1041.00 | NIST | |
| Inp | 1041.00 | NIST | |
| Tboil | 422.56 | K | Joback Calculated Property |
| Tc | 640.79 | K | Joback Calculated Property |
| Tfus | 205.70 | K | Joback Calculated Property |
| Vc | 0.367 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [174.76; 225.11] | J/mol×K | [422.56; 640.79] |
|
| Cp,gas | 174.76 | J/mol×K | 422.56 | Joback Calculated Property |
| Cp,gas | 184.17 | J/mol×K | 458.93 | Joback Calculated Property |
| Cp,gas | 193.17 | J/mol×K | 495.30 | Joback Calculated Property |
| Cp,gas | 201.76 | J/mol×K | 531.68 | Joback Calculated Property |
| Cp,gas | 209.94 | J/mol×K | 568.05 | Joback Calculated Property |
| Cp,gas | 217.72 | J/mol×K | 604.42 | Joback Calculated Property |
| Cp,gas | 225.11 | J/mol×K | 640.79 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 4-Thia-1-pentanethiol.
Sources
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