- InChI
- InChI=1S/C4H8S5/c1-3-5-6-4(2)8-9-7-3/h3-4H,1-2H3/t3-,4+
- InChI Key
- NGHSPVUOJNZCHU-ZXZARUISSA-N
- Formula
- C4H8S5
- SMILES
- CC1SSSC(C)SS1
- Molecular Weight1
- 216.43
- 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° | 186.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 128.23 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.21 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 53.85 | kJ/mol | Joback Calculated Property |
| log10WS | -5.00 | Crippen Calculated Property | |
| logPoct/wat | 4.103 | Crippen Calculated Property | |
| McVol | 138.110 | ml/mol | McGowan Calculated Property |
| Pc | 4856.20 | kPa | Joback Calculated Property |
| Inp | [1628.00; 1628.00] |
|
|
| Inp | 1628.00 | NIST | |
| Inp | 1628.00 | NIST | |
| Inp | 1628.00 | NIST | |
| Tboil | 549.22 | K | Joback Calculated Property |
| Tc | 858.06 | K | Joback Calculated Property |
| Tfus | 551.71 | K | Joback Calculated Property |
| Vc | 0.413 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [266.08; 332.48] | J/mol×K | [549.22; 858.06] |
|
| Cp,gas | 266.08 | J/mol×K | 549.22 | Joback Calculated Property |
| Cp,gas | 279.83 | J/mol×K | 600.69 | Joback Calculated Property |
| Cp,gas | 292.47 | J/mol×K | 652.17 | Joback Calculated Property |
| Cp,gas | 304.03 | J/mol×K | 703.64 | Joback Calculated Property |
| Cp,gas | 314.54 | J/mol×K | 755.11 | Joback Calculated Property |
| Cp,gas | 324.01 | J/mol×K | 806.59 | Joback Calculated Property |
| Cp,gas | 332.48 | J/mol×K | 858.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2,3,5,6-Pentathiepane, 4,7-dimethyl, #2.
Sources
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