- InChI
- InChI=1S/C26H40O5/c1-4-5-6-7-8-9-12-19-29-25(27)23-13-10-11-14-24(23)26(28)31-22-17-15-21(16-18-22)30-20(2)3/h15-18,20,23-24H,4-14,19H2,1-3H3
- InChI Key
- MTDUZCPRZMIQST-UHFFFAOYSA-N
- Formula
- C26H40O5
- SMILES
-
CCCCCCCCCOC(=O)C1CCCCC1C(=O)Oc
1ccc(OC(C)C)cc1 - Molecular Weight1
- 432.59
- Other Names
-
- 1,2-Cyclohexanedicarboxylic acid, 4-isopropylphenyl nonyl ester
- 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° | -287.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -948.03 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 52.89 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 96.86 | kJ/mol | Joback Calculated Property |
| log10WS | -7.41 | Crippen Calculated Property | |
| logPoct/wat | 6.479 | Crippen Calculated Property | |
| McVol | 363.330 | ml/mol | McGowan Calculated Property |
| Pc | 1012.30 | kPa | Joback Calculated Property |
| Inp | [2959.00; 2959.00] |
|
|
| Inp | 2959.00 | NIST | |
| Inp | 2959.00 | NIST | |
| Tboil | 1015.38 | K | Joback Calculated Property |
| Tc | 1243.74 | K | Joback Calculated Property |
| Tfus | 576.41 | K | Joback Calculated Property |
| Vc | 1.375 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1271.79; 1334.80] | J/mol×K | [1015.38; 1243.74] |
|
| Cp,gas | 1271.79 | J/mol×K | 1015.38 | Joback Calculated Property |
| Cp,gas | 1287.30 | J/mol×K | 1053.44 | Joback Calculated Property |
| Cp,gas | 1300.76 | J/mol×K | 1091.50 | Joback Calculated Property |
| Cp,gas | 1312.21 | J/mol×K | 1129.56 | Joback Calculated Property |
| Cp,gas | 1321.68 | J/mol×K | 1167.62 | Joback Calculated Property |
| Cp,gas | 1329.20 | J/mol×K | 1205.68 | Joback Calculated Property |
| Cp,gas | 1334.80 | J/mol×K | 1243.74 | Joback Calculated Property |
| η | [0.0000211; 0.0002945] | Pa×s | [576.41; 1015.38] |
|
| η | 0.0002945 | Pa×s | 576.41 | Joback Calculated Property |
| η | 0.0001482 | Pa×s | 649.57 | Joback Calculated Property |
| η | 0.0000857 | Pa×s | 722.73 | Joback Calculated Property |
| η | 0.0000548 | Pa×s | 795.89 | Joback Calculated Property |
| η | 0.0000378 | Pa×s | 869.06 | Joback Calculated Property |
| η | 0.0000276 | Pa×s | 942.22 | Joback Calculated Property |
| η | 0.0000211 | Pa×s | 1015.38 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, nonyl 4-isopropyloxyphenyl dieste.
Sources
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