- InChI
- InChI=1S/C23H40O4/c1-4-5-6-7-8-9-12-17-26-22(24)20-15-10-11-16-21(20)23(25)27-18-13-14-19(2)3/h10-11,19-21H,4-9,12-18H2,1-3H3
- InChI Key
- DKICQLQCSBGJMM-UHFFFAOYSA-N
- Formula
- C23H40O4
- SMILES
-
CCCCCCCCCOC(=O)C1CC=CCC1C(=O)O
CCCC(C)C - Molecular Weight1
- 380.56
- 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° | -280.80 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -921.17 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 51.50 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.13 | kJ/mol | Joback Calculated Property |
| log10WS | -6.20 | Crippen Calculated Property | |
| logPoct/wat | 5.842 | Crippen Calculated Property | |
| McVol | 334.650 | ml/mol | McGowan Calculated Property |
| Pc | 1028.60 | kPa | Joback Calculated Property |
| Inp | [2540.00; 2540.00] |
|
|
| Inp | 2540.00 | NIST | |
| Inp | 2540.00 | NIST | |
| Tboil | 891.82 | K | Joback Calculated Property |
| Tc | 1094.61 | K | Joback Calculated Property |
| Tfus | 482.19 | K | Joback Calculated Property |
| Vc | 1.284 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1126.49; 1218.41] | J/mol×K | [891.82; 1094.61] |
|
| Cp,gas | 1126.49 | J/mol×K | 891.82 | Joback Calculated Property |
| Cp,gas | 1145.43 | J/mol×K | 925.62 | Joback Calculated Property |
| Cp,gas | 1162.89 | J/mol×K | 959.42 | Joback Calculated Property |
| Cp,gas | 1178.89 | J/mol×K | 993.22 | Joback Calculated Property |
| Cp,gas | 1193.46 | J/mol×K | 1027.01 | Joback Calculated Property |
| Cp,gas | 1206.62 | J/mol×K | 1060.81 | Joback Calculated Property |
| Cp,gas | 1218.41 | J/mol×K | 1094.61 | Joback Calculated Property |
| η | [0.0000458; 0.0008228] | Pa×s | [482.19; 891.82] |
|
| η | 0.0008228 | Pa×s | 482.19 | Joback Calculated Property |
| η | 0.0003773 | Pa×s | 550.46 | Joback Calculated Property |
| η | 0.0002055 | Pa×s | 618.73 | Joback Calculated Property |
| η | 0.0001263 | Pa×s | 687.00 | Joback Calculated Property |
| η | 0.0000847 | Pa×s | 755.28 | Joback Calculated Property |
| η | 0.0000608 | Pa×s | 823.55 | Joback Calculated Property |
| η | 0.0000458 | Pa×s | 891.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, isohexyl nonyl ester.
Sources
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