- InChI
- InChI=1S/C3H8S2/c1-5-3-2-4/h4H,2-3H2,1H3
- InChI Key
- SJJZGKUOHPJHDH-UHFFFAOYSA-N
- Formula
- C3H8S2
- SMILES
- CSCCS
- Molecular Weight1
- 108.23
- ω : Acentric Factor.
- 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).
- 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).
- 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 |
|---|---|---|---|
| ω | 0.3205 | Relay (... Calculated Property | |
| ΔfG° | 36.89 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -50.26 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 11.70 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 43.86 | kJ/mol | Relay (... Calculated Property |
| IE | 8.98 | eV | Relay (... Calculated Property |
| log10WS | -0.76 | Relay (... Calculated Property | |
| logPoct/wat | 1.279 | Crippen Calculated Property | |
| McVol | 85.830 | ml/mol | McGowan Calculated Property |
| Pc | 4924.59 | kPa | Joback Calculated Property |
| Inp | 938.00 | NIST | |
| Tboil | 431.50 | K | Relay (... Calculated Property |
| Tc | 677.70 | K | Relay (... Calculated Property |
| Tfus | 181.70 | K | Relay (... Calculated Property |
| Vc | 0.293 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [139.49; 181.11] | J/mol×K | [399.68; 620.54] | 
|
| Cp,gas | 139.49 | J/mol×K | 399.68 | Joback Calculated Property |
| Cp,gas | 147.23 | J/mol×K | 436.49 | Joback Calculated Property |
| Cp,gas | 154.64 | J/mol×K | 473.30 | Joback Calculated Property |
| Cp,gas | 161.74 | J/mol×K | 510.11 | Joback Calculated Property |
| Cp,gas | 168.51 | J/mol×K | 546.92 | Joback Calculated Property |
| Cp,gas | 174.97 | J/mol×K | 583.73 | Joback Calculated Property |
| Cp,gas | 181.11 | J/mol×K | 620.54 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 3-Thia-1-butanethiol.
Sources
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