- InChI
- InChI=1S/C18H38OS/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17-20-18-16-19/h19H,2-18H2,1H3
- InChI Key
- PDOIABQTPMOHQQ-UHFFFAOYSA-N
- Formula
- C18H38OS
- SMILES
- CCCCCCCCCCCCCCCCSCCO
- Molecular Weight1
- 302.56
- CAS
- 23248-47-7
- 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).
- 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 | 1.0588 | Relay (... Calculated Property | |
| ΔfG° | -3.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -557.19 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 50.59 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 125.38 | kJ/mol | Relay (... Calculated Property |
| IE | 9.12 | eV | Relay (... Calculated Property |
| log10WS | -6.75 | Relay (... Calculated Property | |
| logPoct/wat | 6.193 | Crippen Calculated Property | |
| McVol | 286.700 | ml/mol | McGowan Calculated Property |
| Pc | 1242.46 | kPa | Joback Calculated Property |
| Tboil | 633.27 | K | Relay (... Calculated Property |
| Tc | 819.15 | K | Relay (... Calculated Property |
| Tfus | 323.27 | K | Relay (... Calculated Property |
| Vc | 1.093 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [878.17; 971.78] | J/mol×K | [772.20; 949.73] | 
|
| Cp,gas | 878.17 | J/mol×K | 772.20 | Joback Calculated Property |
| Cp,gas | 895.87 | J/mol×K | 801.79 | Joback Calculated Property |
| Cp,gas | 912.69 | J/mol×K | 831.38 | Joback Calculated Property |
| Cp,gas | 928.66 | J/mol×K | 860.97 | Joback Calculated Property |
| Cp,gas | 943.81 | J/mol×K | 890.55 | Joback Calculated Property |
| Cp,gas | 958.17 | J/mol×K | 920.14 | Joback Calculated Property |
| Cp,gas | 971.78 | J/mol×K | 949.73 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Ethanol, 2-hexadecylthio-.
Sources
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