- InChI
- InChI=1S/C13H22O4/c1-4-16-12(14)10-7-5-6-8-11(10)13(15)17-9(2)3/h9-11H,4-8H2,1-3H3
- InChI Key
- SRBJOBVOYKMWDX-UHFFFAOYSA-N
- Formula
- C13H22O4
- SMILES
- CCOC(=O)C1CCCCC1C(=O)OC(C)C
- Molecular Weight1
- 242.31
- 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° | -394.96 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -772.55 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 24.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 62.58 | kJ/mol | Joback Calculated Property |
| log10WS | -2.51 | Crippen Calculated Property | |
| logPoct/wat | 2.308 | Crippen Calculated Property | |
| McVol | 198.050 | ml/mol | McGowan Calculated Property |
| Pc | 2077.43 | kPa | Joback Calculated Property |
| Inp | [1741.00; 1741.00] |
|
|
| Inp | 1741.00 | NIST | |
| Inp | 1741.00 | NIST | |
| Tboil | 663.86 | K | Joback Calculated Property |
| Tc | 869.51 | K | Joback Calculated Property |
| Tfus | 368.73 | K | Joback Calculated Property |
| Vc | 0.738 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [563.65; 657.80] | J/mol×K | [663.86; 869.51] |
|
| Cp,gas | 563.65 | J/mol×K | 663.86 | Joback Calculated Property |
| Cp,gas | 582.05 | J/mol×K | 698.13 | Joback Calculated Property |
| Cp,gas | 599.36 | J/mol×K | 732.41 | Joback Calculated Property |
| Cp,gas | 615.59 | J/mol×K | 766.68 | Joback Calculated Property |
| Cp,gas | 630.75 | J/mol×K | 800.96 | Joback Calculated Property |
| Cp,gas | 644.82 | J/mol×K | 835.23 | Joback Calculated Property |
| Cp,gas | 657.80 | J/mol×K | 869.51 | Joback Calculated Property |
| η | [0.0001584; 0.0022079] | Pa×s | [368.73; 663.86] |
|
| η | 0.0022079 | Pa×s | 368.73 | Joback Calculated Property |
| η | 0.0010990 | Pa×s | 417.92 | Joback Calculated Property |
| η | 0.0006337 | Pa×s | 467.11 | Joback Calculated Property |
| η | 0.0004058 | Pa×s | 516.30 | Joback Calculated Property |
| η | 0.0002808 | Pa×s | 565.48 | Joback Calculated Property |
| η | 0.0002061 | Pa×s | 614.67 | Joback Calculated Property |
| η | 0.0001584 | Pa×s | 663.86 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, ethyl isopropyl ester.
Sources
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