- InChI
- InChI=1S/C14H24O4/c1-4-17-13(15)11-7-5-6-8-12(11)14(16)18-9-10(2)3/h10-12H,4-9H2,1-3H3
- InChI Key
- QJUFFMQQPBZLBA-UHFFFAOYSA-N
- Formula
- C14H24O4
- SMILES
- CCOC(=O)C1CCCCC1C(=O)OCC(C)C
- Molecular Weight1
- 256.34
- 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° | -386.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -793.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 26.97 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 64.80 | kJ/mol | Joback Calculated Property |
| log10WS | -2.58 | Crippen Calculated Property | |
| logPoct/wat | 2.555 | Crippen Calculated Property | |
| McVol | 212.140 | ml/mol | McGowan Calculated Property |
| Pc | 1906.90 | kPa | Joback Calculated Property |
| Inp | [1699.00; 1699.00] |
|
|
| Inp | 1699.00 | NIST | |
| Inp | 1699.00 | NIST | |
| Tboil | 686.74 | K | Joback Calculated Property |
| Tc | 889.72 | K | Joback Calculated Property |
| Tfus | 380.00 | K | Joback Calculated Property |
| Vc | 0.793 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [618.58; 713.89] | J/mol×K | [686.74; 889.72] |
|
| Cp,gas | 618.58 | J/mol×K | 686.74 | Joback Calculated Property |
| Cp,gas | 637.25 | J/mol×K | 720.57 | Joback Calculated Property |
| Cp,gas | 654.81 | J/mol×K | 754.40 | Joback Calculated Property |
| Cp,gas | 671.25 | J/mol×K | 788.23 | Joback Calculated Property |
| Cp,gas | 686.57 | J/mol×K | 822.06 | Joback Calculated Property |
| Cp,gas | 700.78 | J/mol×K | 855.89 | Joback Calculated Property |
| Cp,gas | 713.89 | J/mol×K | 889.72 | Joback Calculated Property |
| η | [0.0001411; 0.0020571] | Pa×s | [380.00; 686.74] |
|
| η | 0.0020571 | Pa×s | 380.00 | Joback Calculated Property |
| η | 0.0010100 | Pa×s | 431.12 | Joback Calculated Property |
| η | 0.0005766 | Pa×s | 482.25 | Joback Calculated Property |
| η | 0.0003665 | Pa×s | 533.37 | Joback Calculated Property |
| η | 0.0002522 | Pa×s | 584.49 | Joback Calculated Property |
| η | 0.0001843 | Pa×s | 635.62 | Joback Calculated Property |
| η | 0.0001411 | Pa×s | 686.74 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, ethyl isobutyl ester.
Sources
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