- InChI
- InChI=1S/C12H24O2S4/c1-5-15-9-10-17-7-3-14-4-8-18-12-11-16-6-2-13-1/h1-12H2
- InChI Key
- BFVXNKXLPBNMQI-UHFFFAOYSA-N
- Formula
- C12H24O2S4
- SMILES
- C1CSCCSCCOCCSCCSCCO1
- Molecular Weight1
- 328.58
- CAS
- 296-40-2
- 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 | 0.2977 | Relay (1.0) Calculated Property | |
| ΔfG° | -75.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -467.34 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 22.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 109.83 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.14 | eV | Relay (1.0) Calculated Property |
| log10WS | -1.54 | Relay (1.0) Calculated Property | |
| logPoct/wat | 2.966 | Crippen Calculated Property | |
| McVol | 246.220 | ml/mol | McGowan Calculated Property |
| Pc | 2847.48 | kPa | Joback Calculated Property |
| Inp | 2833.00 | NIST | |
| Tboil | 699.96 | K | Relay (1.0) Calculated Property |
| Tc | 944.68 | K | Relay (1.0) Calculated Property |
| Tfus | 370.31 | K | Relay (1.0) Calculated Property |
| Vc | 0.729 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [709.89; 795.53] | J/mol×K | [794.64; 1128.14] | 
|
| Cp,gas | 709.89 | J/mol×K | 794.64 | Joback Calculated Property |
| Cp,gas | 735.46 | J/mol×K | 850.22 | Joback Calculated Property |
| Cp,gas | 756.75 | J/mol×K | 905.81 | Joback Calculated Property |
| Cp,gas | 773.58 | J/mol×K | 961.39 | Joback Calculated Property |
| Cp,gas | 785.77 | J/mol×K | 1016.97 | Joback Calculated Property |
| Cp,gas | 793.15 | J/mol×K | 1072.56 | Joback Calculated Property |
| Cp,gas | 795.53 | J/mol×K | 1128.14 | Joback Calculated Property |
Similar Compounds
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Sources
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