- InChI
- InChI=1S/C10H16OS/c1-2-3-4-5-6-9-7-8-10(12)11-9/h7H,2-6,8H2,1H3
- InChI Key
- QFZICPCAFWUSMA-UHFFFAOYSA-N
- Formula
- C10H16OS
- SMILES
- CCCCCCC1=CCC(=S)O1
- Molecular Weight1
- 184.30
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.4864 | Relay (... Calculated Property | |
| ΔfG° | 102.64 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -205.00 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 29.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.20 | kJ/mol | Relay (... Calculated Property |
| IE | 8.36 | eV | Relay (... Calculated Property |
| log10WS | -4.82 | Relay (... Calculated Property | |
| logPoct/wat | 3.588 | Crippen Calculated Property | |
| McVol | 154.520 | ml/mol | McGowan Calculated Property |
| Pc | 2802.44 | kPa | Joback Calculated Property |
| Inp | [1584.00; 1584.00] |
|
|
| Inp | 1584.00 | NIST | |
| Inp | 1584.00 | NIST | |
| I | [2355.00; 2355.00] |
|
|
| I | 2355.00 | NIST | |
| I | 2355.00 | NIST | |
| Tboil | 535.74 | K | Relay (... Calculated Property |
| Tc | 740.53 | K | Relay (... Calculated Property |
| Tfus | 280.20 | K | Relay (... Calculated Property |
| Vc | 0.556 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [358.16; 431.16] | J/mol×K | [551.88; 762.75] |
|
| Cp,gas | 358.16 | J/mol×K | 551.88 | Joback Calculated Property |
| Cp,gas | 372.27 | J/mol×K | 587.03 | Joback Calculated Property |
| Cp,gas | 385.53 | J/mol×K | 622.17 | Joback Calculated Property |
| Cp,gas | 398.00 | J/mol×K | 657.32 | Joback Calculated Property |
| Cp,gas | 409.72 | J/mol×K | 692.46 | Joback Calculated Property |
| Cp,gas | 420.76 | J/mol×K | 727.61 | Joback Calculated Property |
| Cp,gas | 431.16 | J/mol×K | 762.75 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 5-hexyl-dihydrofuran-2(3H)-thione.
Sources
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