- InChI
- InChI=1S/C16H28O4/c1-3-5-6-9-12-20-16(18)14-11-8-7-10-13(14)15(17)19-4-2/h13-14H,3-12H2,1-2H3
- InChI Key
- DNFPNUCSOCQYSZ-UHFFFAOYSA-N
- Formula
- C16H28O4
- SMILES
- CCCCCCOC(=O)C1CCCCC1C(=O)OCC
- Molecular Weight1
- 284.39
- 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° | -367.26 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -829.19 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.68 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 69.64 | kJ/mol | Joback Calculated Property |
| log10WS | -3.66 | Crippen Calculated Property | |
| logPoct/wat | 3.479 | Crippen Calculated Property | |
| McVol | 240.320 | ml/mol | McGowan Calculated Property |
| Pc | 1612.88 | kPa | Joback Calculated Property |
| Inp | [1935.00; 1935.00] |
|
|
| Inp | 1935.00 | NIST | |
| Inp | 1935.00 | NIST | |
| Tboil | 732.94 | K | Joback Calculated Property |
| Tc | 929.01 | K | Joback Calculated Property |
| Tfus | 417.54 | K | Joback Calculated Property |
| Vc | 0.911 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [731.43; 826.93] | J/mol×K | [732.94; 929.01] |
|
| Cp,gas | 731.43 | J/mol×K | 732.94 | Joback Calculated Property |
| Cp,gas | 750.19 | J/mol×K | 765.62 | Joback Calculated Property |
| Cp,gas | 767.80 | J/mol×K | 798.30 | Joback Calculated Property |
| Cp,gas | 784.28 | J/mol×K | 830.97 | Joback Calculated Property |
| Cp,gas | 799.62 | J/mol×K | 863.65 | Joback Calculated Property |
| Cp,gas | 813.84 | J/mol×K | 896.33 | Joback Calculated Property |
| Cp,gas | 826.93 | J/mol×K | 929.01 | Joback Calculated Property |
| η | [0.0001198; 0.0014656] | Pa×s | [417.54; 732.94] |
|
| η | 0.0014656 | Pa×s | 417.54 | Joback Calculated Property |
| η | 0.0007645 | Pa×s | 470.11 | Joback Calculated Property |
| η | 0.0004546 | Pa×s | 522.67 | Joback Calculated Property |
| η | 0.0002972 | Pa×s | 575.24 | Joback Calculated Property |
| η | 0.0002087 | Pa×s | 627.81 | Joback Calculated Property |
| η | 0.0001547 | Pa×s | 680.37 | Joback Calculated Property |
| η | 0.0001198 | Pa×s | 732.94 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, ethyl hexyl ester.
Sources
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