- InChI
- InChI=1S/C3H6S4/c1-3-6-4-2-5-7-3/h3H,2H2,1H3
- InChI Key
- VWHXUHVCDBTZGT-UHFFFAOYSA-N
- Formula
- C3H6S4
- SMILES
- CC1SSCSS1
- Molecular Weight1
- 170.34
- 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° | 158.27 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 130.11 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 45.95 | kJ/mol | Joback Calculated Property |
| log10WS | -3.59 | Crippen Calculated Property | |
| logPoct/wat | 3.066 | Crippen Calculated Property | |
| McVol | 107.670 | ml/mol | McGowan Calculated Property |
| Pc | 5695.98 | kPa | Joback Calculated Property |
| Inp | [1362.00; 1362.00] |
|
|
| Inp | 1362.00 | NIST | |
| Inp | 1362.00 | NIST | |
| Tboil | 478.91 | K | Joback Calculated Property |
| Tc | 766.95 | K | Joback Calculated Property |
| Tfus | 464.75 | K | Joback Calculated Property |
| Vc | 0.321 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [186.14; 238.82] | J/mol×K | [478.91; 766.95] |
|
| Cp,gas | 186.14 | J/mol×K | 478.91 | Joback Calculated Property |
| Cp,gas | 196.91 | J/mol×K | 526.92 | Joback Calculated Property |
| Cp,gas | 206.82 | J/mol×K | 574.92 | Joback Calculated Property |
| Cp,gas | 215.92 | J/mol×K | 622.93 | Joback Calculated Property |
| Cp,gas | 224.26 | J/mol×K | 670.94 | Joback Calculated Property |
| Cp,gas | 231.88 | J/mol×K | 718.94 | Joback Calculated Property |
| Cp,gas | 238.82 | J/mol×K | 766.95 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methyl 1,2,4,5-tetrathiane.
Sources
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