- InChI
- InChI=1S/C23H42O4/c1-4-5-6-7-8-9-10-11-14-17-26-22(24)20-15-12-13-16-21(20)23(25)27-18-19(2)3/h19-21H,4-18H2,1-3H3
- InChI Key
- KFFISQLLHSGQKG-UHFFFAOYSA-N
- Formula
- C23H42O4
- SMILES
-
CCCCCCCCCCCOC(=O)C1CCCCC1C(=O)
OCC(C)C - Molecular Weight1
- 382.58
- 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° | -310.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -978.95 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 50.28 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.84 | kJ/mol | Joback Calculated Property |
| log10WS | -6.34 | Crippen Calculated Property | |
| logPoct/wat | 6.066 | Crippen Calculated Property | |
| McVol | 338.950 | ml/mol | McGowan Calculated Property |
| Pc | 1005.26 | kPa | Joback Calculated Property |
| Inp | [2596.00; 2596.00] |
|
|
| Inp | 2596.00 | NIST | |
| Inp | 2596.00 | NIST | |
| Tboil | 892.66 | K | Joback Calculated Property |
| Tc | 1095.22 | K | Joback Calculated Property |
| Tfus | 481.43 | K | Joback Calculated Property |
| Vc | 1.298 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1156.06; 1251.39] | J/mol×K | [892.66; 1095.22] |
|
| Cp,gas | 1156.06 | J/mol×K | 892.66 | Joback Calculated Property |
| Cp,gas | 1175.71 | J/mol×K | 926.42 | Joback Calculated Property |
| Cp,gas | 1193.82 | J/mol×K | 960.18 | Joback Calculated Property |
| Cp,gas | 1210.41 | J/mol×K | 993.94 | Joback Calculated Property |
| Cp,gas | 1225.52 | J/mol×K | 1027.70 | Joback Calculated Property |
| Cp,gas | 1239.17 | J/mol×K | 1061.46 | Joback Calculated Property |
| Cp,gas | 1251.39 | J/mol×K | 1095.22 | Joback Calculated Property |
| η | [0.0000422; 0.0008412] | Pa×s | [481.43; 892.66] |
|
| η | 0.0008412 | Pa×s | 481.43 | Joback Calculated Property |
| η | 0.0003744 | Pa×s | 549.97 | Joback Calculated Property |
| η | 0.0001994 | Pa×s | 618.51 | Joback Calculated Property |
| η | 0.0001204 | Pa×s | 687.04 | Joback Calculated Property |
| η | 0.0000797 | Pa×s | 755.58 | Joback Calculated Property |
| η | 0.0000565 | Pa×s | 824.12 | Joback Calculated Property |
| η | 0.0000422 | Pa×s | 892.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, isobutyl undecyl ester.
Sources
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