- InChI
- InChI=1S/C20H38O2/c1-2-3-4-5-6-7-8-9-10-11-15-18-22-20(21)19-16-13-12-14-17-19/h19H,2-18H2,1H3
- InChI Key
- NYSRVOQLCGJDRW-UHFFFAOYSA-N
- Formula
- C20H38O2
- SMILES
- CCCCCCCCCCCCCOC(=O)C1CCCCC1
- Molecular Weight1
- 310.51
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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.
- 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 | 0.8606 | Relay (1.0) Calculated Property | |
| ΔfG° | -91.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -714.51 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 42.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -6.67 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.421 | Crippen Calculated Property | |
| McVol | 289.240 | ml/mol | McGowan Calculated Property |
| Pc | 1199.79 | kPa | Joback Calculated Property |
| Inp | 2240.00 | NIST | |
| Tboil | 617.64 | K | Relay (1.0) Calculated Property |
| Tc | 821.83 | K | Relay (1.0) Calculated Property |
| Tfus | 301.41 | K | Relay (1.0) Calculated Property |
| Vc | 1.089 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [906.57; 1016.41] | J/mol×K | [752.84; 939.55] | 
|
| Cp,gas | 906.57 | J/mol×K | 752.84 | Joback Calculated Property |
| Cp,gas | 927.73 | J/mol×K | 783.96 | Joback Calculated Property |
| Cp,gas | 947.70 | J/mol×K | 815.08 | Joback Calculated Property |
| Cp,gas | 966.52 | J/mol×K | 846.19 | Joback Calculated Property |
| Cp,gas | 984.23 | J/mol×K | 877.31 | Joback Calculated Property |
| Cp,gas | 1000.85 | J/mol×K | 908.43 | Joback Calculated Property |
| Cp,gas | 1016.41 | J/mol×K | 939.55 | Joback Calculated Property |
| η | [0.0000765; 0.0019497] | Pa×s | [394.70; 752.84] |
|
| η | 0.0019497 | Pa×s | 394.70 | Joback Calculated Property |
| η | 0.0007974 | Pa×s | 454.39 | Joback Calculated Property |
| η | 0.0004014 | Pa×s | 514.08 | Joback Calculated Property |
| η | 0.0002331 | Pa×s | 573.77 | Joback Calculated Property |
| η | 0.0001499 | Pa×s | 633.46 | Joback Calculated Property |
| η | 0.0001041 | Pa×s | 693.15 | Joback Calculated Property |
| η | 0.0000765 | Pa×s | 752.84 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Cyclohexanecarboxylic acid, tridecyl ester.
Sources
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