- InChI
- InChI=1S/C15H32O3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-19(2,16)17/h3-15H2,1-2H3
- InChI Key
- SHHTUKUQKILIDO-UHFFFAOYSA-N
- Formula
- C15H32O3S
- SMILES
- CCCCCCCCCCCCCCOS(C)(=O)=O
- Molecular Weight1
- 292.48
- CAS
- 6222-16-8
- 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 | 0.8933 | Relay (1.0) Calculated Property | |
| ΔfG° | -498.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -830.24 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.17 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.29 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 10.26 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.09 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.664 | Crippen Calculated Property | |
| McVol | 256.170 | ml/mol | McGowan Calculated Property |
| Pc | 1574.70 | kPa | Joback Calculated Property |
| Tboil | 614.61 | K | Relay (1.0) Calculated Property |
| Tc | 794.42 | K | Relay (1.0) Calculated Property |
| Tfus | 303.59 | K | Relay (1.0) Calculated Property |
| Vc | 0.995 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [685.61; 783.92] | J/mol×K | [612.80; 771.87] | 
|
| Cp,gas | 685.61 | J/mol×K | 612.80 | Joback Calculated Property |
| Cp,gas | 703.81 | J/mol×K | 639.31 | Joback Calculated Property |
| Cp,gas | 721.28 | J/mol×K | 665.82 | Joback Calculated Property |
| Cp,gas | 738.02 | J/mol×K | 692.34 | Joback Calculated Property |
| Cp,gas | 754.03 | J/mol×K | 718.85 | Joback Calculated Property |
| Cp,gas | 769.33 | J/mol×K | 745.36 | Joback Calculated Property |
| Cp,gas | 783.92 | J/mol×K | 771.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Tetradecyl methanesulfonate.
Sources
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