- InChI
- InChI=1S/C5H10S2/c1-4-5(6)2-3-7-4/h4-6H,2-3H2,1H3
- InChI Key
- DPEXPKGKIRGPKJ-UHFFFAOYSA-N
- Formula
- C5H10S2
- SMILES
- CC1SCCC1S
- Molecular Weight1
- 134.26
- 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° | 89.31 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -22.65 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 11.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.22 | kJ/mol | Joback Calculated Property |
| log10WS | -1.99 | Crippen Calculated Property | |
| logPoct/wat | 1.810 | Crippen Calculated Property | |
| McVol | 103.150 | ml/mol | McGowan Calculated Property |
| Pc | 4486.22 | kPa | Joback Calculated Property |
| Inp | [1042.00; 1060.00] |
|
|
| Inp | 1042.00 | NIST | |
| Inp | 1060.00 | NIST | |
| Inp | 1042.00 | NIST | |
| Tboil | 435.10 | K | Joback Calculated Property |
| Tc | 678.52 | K | Joback Calculated Property |
| Tfus | 272.68 | K | Joback Calculated Property |
| Vc | 0.355 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [190.46; 261.86] | J/mol×K | [435.10; 678.52] |
|
| Cp,gas | 190.46 | J/mol×K | 435.10 | Joback Calculated Property |
| Cp,gas | 204.37 | J/mol×K | 475.67 | Joback Calculated Property |
| Cp,gas | 217.43 | J/mol×K | 516.24 | Joback Calculated Property |
| Cp,gas | 229.68 | J/mol×K | 556.81 | Joback Calculated Property |
| Cp,gas | 241.15 | J/mol×K | 597.38 | Joback Calculated Property |
| Cp,gas | 251.87 | J/mol×K | 637.95 | Joback Calculated Property |
| Cp,gas | 261.86 | J/mol×K | 678.52 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2-Methylthiolan-3-thiol.
Sources
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