- InChI
- InChI=1S/C20H36O4/c1-6-7-8-9-10-11-12-13-16-23-18(21)14-15-19(22)24-17(2)20(3,4)5/h14-15,17H,6-13,16H2,1-5H3/b15-14+
- InChI Key
- CETPITKVFMBCFW-CCEZHUSRSA-N
- Formula
- C20H36O4
- SMILES
-
CCCCCCCCCCOC(=O)C=CC(=O)OC(C)C
(C)(C)C - Molecular Weight1
- 340.50
- 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).
- 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 |
|---|---|---|---|
| ΔfG° | -269.70 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -842.54 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.70 | kJ/mol | Joback Calculated Property |
| log10WS | -5.64 | Crippen Calculated Property | |
| logPoct/wat | 5.204 | Crippen Calculated Property | |
| McVol | 303.240 | ml/mol | McGowan Calculated Property |
| Pc | 1135.96 | kPa | Joback Calculated Property |
| Inp | [2234.00; 2234.00] |
|
|
| Inp | 2234.00 | NIST | |
| Inp | 2234.00 | NIST | |
| Tboil | 810.07 | K | Joback Calculated Property |
| Tc | 1000.27 | K | Joback Calculated Property |
| Tfus | 441.82 | K | Joback Calculated Property |
| Vc | 1.167 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [945.41; 1037.72] | J/mol×K | [810.07; 1000.27] |
|
| Cp,gas | 945.41 | J/mol×K | 810.07 | Joback Calculated Property |
| Cp,gas | 963.23 | J/mol×K | 841.77 | Joback Calculated Property |
| Cp,gas | 980.02 | J/mol×K | 873.47 | Joback Calculated Property |
| Cp,gas | 995.83 | J/mol×K | 905.17 | Joback Calculated Property |
| Cp,gas | 1010.68 | J/mol×K | 936.87 | Joback Calculated Property |
| Cp,gas | 1024.63 | J/mol×K | 968.57 | Joback Calculated Property |
| Cp,gas | 1037.72 | J/mol×K | 1000.27 | Joback Calculated Property |
| η | [0.0000340; 0.0009017] | Pa×s | [441.82; 810.07] |
|
| η | 0.0009017 | Pa×s | 441.82 | Joback Calculated Property |
| η | 0.0003743 | Pa×s | 503.20 | Joback Calculated Property |
| η | 0.0001881 | Pa×s | 564.57 | Joback Calculated Property |
| η | 0.0001082 | Pa×s | 625.94 | Joback Calculated Property |
| η | 0.0000687 | Pa×s | 687.32 | Joback Calculated Property |
| η | 0.0000470 | Pa×s | 748.69 | Joback Calculated Property |
| η | 0.0000340 | Pa×s | 810.07 | Joback Calculated Property |
Similar Compounds
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Sources
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