- InChI
- InChI=1S/C15H26O4/c1-4-9-18-14(16)12-7-5-6-8-13(12)15(17)19-10-11(2)3/h11-13H,4-10H2,1-3H3
- InChI Key
- SZAJLQTUDWVUSQ-UHFFFAOYSA-N
- Formula
- C15H26O4
- SMILES
- CCCOC(=O)C1CCCCC1C(=O)OCC(C)C
- Molecular Weight1
- 270.36
- 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° | -378.12 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -813.83 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 29.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.03 | kJ/mol | Joback Calculated Property |
| log10WS | -3.00 | Crippen Calculated Property | |
| logPoct/wat | 2.945 | Crippen Calculated Property | |
| McVol | 226.230 | ml/mol | McGowan Calculated Property |
| Pc | 1756.54 | kPa | Joback Calculated Property |
| Inp | [1790.00; 1790.00] |
|
|
| Inp | 1790.00 | NIST | |
| Inp | 1790.00 | NIST | |
| Tboil | 709.62 | K | Joback Calculated Property |
| Tc | 910.33 | K | Joback Calculated Property |
| Tfus | 391.27 | K | Joback Calculated Property |
| Vc | 0.850 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [674.70; 770.79] | J/mol×K | [709.62; 910.33] |
|
| Cp,gas | 674.70 | J/mol×K | 709.62 | Joback Calculated Property |
| Cp,gas | 693.58 | J/mol×K | 743.07 | Joback Calculated Property |
| Cp,gas | 711.32 | J/mol×K | 776.52 | Joback Calculated Property |
| Cp,gas | 727.90 | J/mol×K | 809.98 | Joback Calculated Property |
| Cp,gas | 743.34 | J/mol×K | 843.43 | Joback Calculated Property |
| Cp,gas | 757.63 | J/mol×K | 876.88 | Joback Calculated Property |
| Cp,gas | 770.79 | J/mol×K | 910.33 | Joback Calculated Property |
| η | [0.0001251; 0.0019030] | Pa×s | [391.27; 709.62] |
|
| η | 0.0019030 | Pa×s | 391.27 | Joback Calculated Property |
| η | 0.0009222 | Pa×s | 444.33 | Joback Calculated Property |
| η | 0.0005216 | Pa×s | 497.39 | Joback Calculated Property |
| η | 0.0003292 | Pa×s | 550.44 | Joback Calculated Property |
| η | 0.0002254 | Pa×s | 603.50 | Joback Calculated Property |
| η | 0.0001640 | Pa×s | 656.56 | Joback Calculated Property |
| η | 0.0001251 | Pa×s | 709.62 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, isobutyl propyl ester.
Sources
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