- InChI
- InChI=1S/C8H16S2/c1-9-7-5-3-4-6-8(7)10-2/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s1
- InChI Key
- UOVDQPXIRFSKOV-HTQZYQBOSA-N
- Formula
- C8H16S2
- SMILES
- CSC1CCCCC1SC
- Molecular Weight1
- 176.34
- 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° | 99.46 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -90.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.64 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 47.16 | kJ/mol | Joback Calculated Property |
| log10WS | -3.06 | Crippen Calculated Property | |
| logPoct/wat | 3.024 | Crippen Calculated Property | |
| McVol | 145.420 | ml/mol | McGowan Calculated Property |
| Pc | 3156.17 | kPa | Joback Calculated Property |
| Inp | 1389.00 | NIST | |
| Tboil | 534.88 | K | Joback Calculated Property |
| Tc | 783.39 | K | Joback Calculated Property |
| Tfus | 251.86 | K | Joback Calculated Property |
| Vc | 0.523 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [328.38; 425.70] | J/mol×K | [534.88; 783.39] | 
|
| Cp,gas | 328.38 | J/mol×K | 534.88 | Joback Calculated Property |
| Cp,gas | 347.50 | J/mol×K | 576.30 | Joback Calculated Property |
| Cp,gas | 365.44 | J/mol×K | 617.72 | Joback Calculated Property |
| Cp,gas | 382.23 | J/mol×K | 659.13 | Joback Calculated Property |
| Cp,gas | 397.87 | J/mol×K | 700.55 | Joback Calculated Property |
| Cp,gas | 412.36 | J/mol×K | 741.97 | Joback Calculated Property |
| Cp,gas | 425.70 | J/mol×K | 783.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexane, 1,2-bis-(methylthio), trans.
Sources
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