- InChI
- InChI=1S/C6H12S4/c1-4-7-5(2)9-10-6(3)8-4/h4-6H,1-3H3
- InChI Key
- WMWRKEXBIGLGBW-UHFFFAOYSA-N
- Formula
- C6H12S4
- SMILES
- CC1SSC(C)SC(C)S1
- Molecular Weight1
- 212.42
- 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° | 156.01 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 21.35 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 17.80 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.18 | kJ/mol | Joback Calculated Property |
| log10WS | -4.58 | Crippen Calculated Property | |
| logPoct/wat | 3.886 | Crippen Calculated Property | |
| McVol | 149.940 | ml/mol | McGowan Calculated Property |
| Pc | 3655.35 | kPa | Joback Calculated Property |
| Inp | [1511.00; 1526.00] |
|
|
| Inp | 1526.00 | NIST | |
| Inp | 1511.00 | NIST | |
| Inp | 1526.00 | NIST | |
| Tboil | 542.48 | K | Joback Calculated Property |
| Tc | 821.95 | K | Joback Calculated Property |
| Tfus | 486.56 | K | Joback Calculated Property |
| Vc | 0.478 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [315.07; 400.73] | J/mol×K | [542.48; 821.95] |
|
| Cp,gas | 315.07 | J/mol×K | 542.48 | Joback Calculated Property |
| Cp,gas | 332.22 | J/mol×K | 589.06 | Joback Calculated Property |
| Cp,gas | 348.20 | J/mol×K | 635.64 | Joback Calculated Property |
| Cp,gas | 363.03 | J/mol×K | 682.22 | Joback Calculated Property |
| Cp,gas | 376.73 | J/mol×K | 728.79 | Joback Calculated Property |
| Cp,gas | 389.29 | J/mol×K | 775.37 | Joback Calculated Property |
| Cp,gas | 400.73 | J/mol×K | 821.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2,4,6-Tetrathiepane, 3,5,7-trimethyl, #1.
Sources
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