- InChI
- InChI=1S/C8H16S/c1-3-4-8-6-5-7(2)9-8/h7-8H,3-6H2,1-2H3/t7-,8-/m1/s1
- InChI Key
- IWKWEUBLOXWCAL-HTQZYQBOSA-N
- Formula
- C8H16S
- SMILES
- CCCC1CCC(C)S1
- Molecular Weight1
- 144.28
- 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° | 85.18 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -123.05 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 15.14 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 39.16 | kJ/mol | Joback Calculated Property |
| log10WS | -3.17 | Crippen Calculated Property | |
| logPoct/wat | 3.071 | Crippen Calculated Property | |
| McVol | 129.070 | ml/mol | McGowan Calculated Property |
| Pc | 2937.70 | kPa | Joback Calculated Property |
| Inp | [1062.00; 1064.00] |
|
|
| Inp | 1062.00 | NIST | |
| Inp | 1064.00 | NIST | |
| Inp | 1062.00 | NIST | |
| Inp | 1064.00 | NIST | |
| Tboil | 440.88 | K | Joback Calculated Property |
| Tc | 648.58 | K | Joback Calculated Property |
| Tfus | 270.03 | K | Joback Calculated Property |
| Vc | 0.469 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [263.71; 353.07] | J/mol×K | [440.88; 648.58] |
|
| Cp,gas | 263.71 | J/mol×K | 440.88 | Joback Calculated Property |
| Cp,gas | 280.64 | J/mol×K | 475.50 | Joback Calculated Property |
| Cp,gas | 296.72 | J/mol×K | 510.11 | Joback Calculated Property |
| Cp,gas | 311.97 | J/mol×K | 544.73 | Joback Calculated Property |
| Cp,gas | 326.43 | J/mol×K | 579.35 | Joback Calculated Property |
| Cp,gas | 340.12 | J/mol×K | 613.97 | Joback Calculated Property |
| Cp,gas | 353.07 | J/mol×K | 648.58 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to trans-2-Methyl-5-propylthiolane.
Sources
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