- InChI
- InChI=1S/C5H12S5/c1-4-5(8-6-2)9-10-7-3/h5H,4H2,1-3H3
- InChI Key
- WQGRDWGJZXYXLX-UHFFFAOYSA-N
- Formula
- C5H12S5
- SMILES
- CCC(SSC)SSSC
- Molecular Weight1
- 232.47
- Other Names
-
- 4-ethyl-2,3,5,6,7-pentathiaoctane
- 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° | 154.38 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | 57.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 25.83 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 60.42 | kJ/mol | Joback Calculated Property |
| log10WS | -4.91 | Crippen Calculated Property | |
| logPoct/wat | 4.393 | Crippen Calculated Property | |
| McVol | 163.060 | ml/mol | McGowan Calculated Property |
| Pc | 3881.95 | kPa | Joback Calculated Property |
| Inp | [1679.00; 1679.00] |
|
|
| Inp | 1679.00 | NIST | |
| Inp | 1679.00 | NIST | |
| Inp | 1679.00 | NIST | |
| Tboil | 657.26 | K | Joback Calculated Property |
| Tc | 942.30 | K | Joback Calculated Property |
| Tfus | 303.11 | K | Joback Calculated Property |
| Vc | 0.580 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [347.46; 404.80] | J/mol×K | [657.26; 942.30] |
|
| Cp,gas | 347.46 | J/mol×K | 657.26 | Joback Calculated Property |
| Cp,gas | 359.93 | J/mol×K | 704.77 | Joback Calculated Property |
| Cp,gas | 371.31 | J/mol×K | 752.27 | Joback Calculated Property |
| Cp,gas | 381.55 | J/mol×K | 799.78 | Joback Calculated Property |
| Cp,gas | 390.58 | J/mol×K | 847.29 | Joback Calculated Property |
| Cp,gas | 398.35 | J/mol×K | 894.79 | Joback Calculated Property |
| Cp,gas | 404.80 | J/mol×K | 942.30 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 2,3,5,6,7-Pentathiaoctane, 4-ethyl.
Sources
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