- InChI
- InChI=1S/C8H12OS/c1-2-3-4-7-5-6-8(10)9-7/h5H,2-4,6H2,1H3
- InChI Key
- RGBBTFSIKXJSSL-UHFFFAOYSA-N
- Formula
- C8H12OS
- SMILES
- CCCCC1=CCC(=S)O1
- Molecular Weight1
- 156.25
- 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.
- I : 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° | 85.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -98.22 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 46.91 | kJ/mol | Joback Calculated Property |
| log10WS | -3.35 | Crippen Calculated Property | |
| logPoct/wat | 2.808 | Crippen Calculated Property | |
| McVol | 126.340 | ml/mol | McGowan Calculated Property |
| Pc | 3472.45 | kPa | Joback Calculated Property |
| Inp | 1389.00 | NIST | |
| I | [2162.00; 2162.00] |
|
|
| I | 2162.00 | NIST | |
| I | 2162.00 | NIST | |
| Tboil | 506.12 | K | Joback Calculated Property |
| Tc | 724.04 | K | Joback Calculated Property |
| Tfus | 298.58 | K | Joback Calculated Property |
| Vc | 0.470 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [268.86; 331.93] | J/mol×K | [506.12; 724.04] |
|
| Cp,gas | 268.86 | J/mol×K | 506.12 | Joback Calculated Property |
| Cp,gas | 281.18 | J/mol×K | 542.44 | Joback Calculated Property |
| Cp,gas | 292.71 | J/mol×K | 578.76 | Joback Calculated Property |
| Cp,gas | 303.50 | J/mol×K | 615.08 | Joback Calculated Property |
| Cp,gas | 313.59 | J/mol×K | 651.40 | Joback Calculated Property |
| Cp,gas | 323.05 | J/mol×K | 687.72 | Joback Calculated Property |
| Cp,gas | 331.93 | J/mol×K | 724.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-butyl-dihydrofuran-2(3H)-thione.
Sources
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