- InChI
- InChI=1S/C19H34O4/c1-4-5-6-7-10-13-22-18(20)16-11-8-9-12-17(16)19(21)23-14-15(2)3/h15-17H,4-14H2,1-3H3
- InChI Key
- MUVKZSVBJFPTOO-UHFFFAOYSA-N
- Formula
- C19H34O4
- SMILES
-
CCCCCCCOC(=O)C1CCCCC1C(=O)OCC(
C)C - Molecular Weight1
- 326.47
- 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° | -344.44 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -896.39 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.92 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.93 | kJ/mol | Joback Calculated Property |
| log10WS | -4.67 | Crippen Calculated Property | |
| logPoct/wat | 4.506 | Crippen Calculated Property | |
| McVol | 282.590 | ml/mol | McGowan Calculated Property |
| Pc | 1303.29 | kPa | Joback Calculated Property |
| Inp | [2175.00; 2175.00] |
|
|
| Inp | 2175.00 | NIST | |
| Inp | 2175.00 | NIST | |
| Tboil | 801.14 | K | Joback Calculated Property |
| Tc | 997.68 | K | Joback Calculated Property |
| Tfus | 436.35 | K | Joback Calculated Property |
| Vc | 1.073 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [909.24; 1006.00] | J/mol×K | [801.14; 997.68] |
|
| Cp,gas | 909.24 | J/mol×K | 801.14 | Joback Calculated Property |
| Cp,gas | 928.59 | J/mol×K | 833.90 | Joback Calculated Property |
| Cp,gas | 946.62 | J/mol×K | 866.65 | Joback Calculated Property |
| Cp,gas | 963.37 | J/mol×K | 899.41 | Joback Calculated Property |
| Cp,gas | 978.84 | J/mol×K | 932.17 | Joback Calculated Property |
| Cp,gas | 993.04 | J/mol×K | 964.93 | Joback Calculated Property |
| Cp,gas | 1006.00 | J/mol×K | 997.68 | Joback Calculated Property |
| η | [0.0000744; 0.0013131] | Pa×s | [436.35; 801.14] |
|
| η | 0.0013131 | Pa×s | 436.35 | Joback Calculated Property |
| η | 0.0006075 | Pa×s | 497.15 | Joback Calculated Property |
| η | 0.0003324 | Pa×s | 557.95 | Joback Calculated Property |
| η | 0.0002048 | Pa×s | 618.75 | Joback Calculated Property |
| η | 0.0001376 | Pa×s | 679.54 | Joback Calculated Property |
| η | 0.0000987 | Pa×s | 740.34 | Joback Calculated Property |
| η | 0.0000744 | Pa×s | 801.14 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, heptyl isobutyl ester.
Sources
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