- InChI
- InChI=1S/C3H6S6/c1-4-2-7-9-8-3-6-5-1/h1-3H2
- InChI Key
- ZOJCTXCAPUGEKN-UHFFFAOYSA-N
- Formula
- C3H6S6
- SMILES
- C1SCSSSCSS1
- Molecular Weight1
- 234.47
- 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° | 209.40 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 222.49 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 9.93 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 58.40 | kJ/mol | Joback Calculated Property |
| log10WS | -4.73 | Crippen Calculated Property | |
| logPoct/wat | 4.017 | Crippen Calculated Property | |
| McVol | 140.370 | ml/mol | McGowan Calculated Property |
| Pc | 6620.58 | kPa | Joback Calculated Property |
| Inp | [1901.00; 1901.00] |
|
|
| Inp | 1901.00 | NIST | |
| Inp | 1901.00 | NIST | |
| Tboil | 592.05 | K | Joback Calculated Property |
| Tc | 951.49 | K | Joback Calculated Property |
| Tfus | 625.33 | K | Joback Calculated Property |
| Vc | 0.390 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [255.34; 311.86] | J/mol×K | [592.05; 951.49] |
|
| Cp,gas | 255.34 | J/mol×K | 592.05 | Joback Calculated Property |
| Cp,gas | 268.22 | J/mol×K | 651.96 | Joback Calculated Property |
| Cp,gas | 279.68 | J/mol×K | 711.86 | Joback Calculated Property |
| Cp,gas | 289.74 | J/mol×K | 771.77 | Joback Calculated Property |
| Cp,gas | 298.43 | J/mol×K | 831.67 | Joback Calculated Property |
| Cp,gas | 305.79 | J/mol×K | 891.58 | Joback Calculated Property |
| Cp,gas | 311.86 | J/mol×K | 951.49 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2,3,5,6,8-hexathiacyclononane.
Sources
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