- InChI
- InChI=1S/C8H18O2S3/c9-3-7-11-5-1-2-6-12-13-8-4-10/h9-10H,1-8H2
- InChI Key
- BNWPXFUBFMWJGZ-UHFFFAOYSA-N
- Formula
- C8H18O2S3
- SMILES
- OCCSCCCCSSCCO
- Molecular Weight1
- 242.42
- 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° | -157.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -387.30 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.04 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 87.21 | kJ/mol | Joback Calculated Property |
| log10WS | -2.34 | Crippen Calculated Property | |
| logPoct/wat | 1.866 | Crippen Calculated Property | |
| McVol | 184.370 | ml/mol | McGowan Calculated Property |
| Pc | 3261.58 | kPa | Joback Calculated Property |
| Inp | 1929.00 | NIST | |
| Tboil | 773.14 | K | Joback Calculated Property |
| Tc | 972.41 | K | Joback Calculated Property |
| Tfus | 404.76 | K | Joback Calculated Property |
| Vc | 0.683 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [494.53; 544.14] | J/mol×K | [773.14; 972.41] | 
|
| Cp,gas | 494.53 | J/mol×K | 773.14 | Joback Calculated Property |
| Cp,gas | 504.44 | J/mol×K | 806.35 | Joback Calculated Property |
| Cp,gas | 513.69 | J/mol×K | 839.56 | Joback Calculated Property |
| Cp,gas | 522.28 | J/mol×K | 872.77 | Joback Calculated Property |
| Cp,gas | 530.22 | J/mol×K | 905.98 | Joback Calculated Property |
| Cp,gas | 537.50 | J/mol×K | 939.19 | Joback Calculated Property |
| Cp,gas | 544.14 | J/mol×K | 972.41 | Joback Calculated Property |
Similar Compounds
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Find more compounds similar to 1-(2-Hydroxyethylthio)-4-(2-hydroxyethyldithio)butane.
Sources
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