- InChI
- InChI=1S/C16H28O4/c1-5-14(11(3)4)20-16(18)13-10-8-7-9-12(13)15(17)19-6-2/h11-14H,5-10H2,1-4H3
- InChI Key
- JVKQKYQRWMWNTO-UHFFFAOYSA-N
- Formula
- C16H28O4
- SMILES
-
CCOC(=O)C1CCCCC1C(=O)OC(CC)C(C
)C - 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° | -372.14 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -839.75 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.63 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 68.87 | kJ/mol | Joback Calculated Property |
| log10WS | -3.53 | Crippen Calculated Property | |
| logPoct/wat | 3.334 | Crippen Calculated Property | |
| McVol | 240.320 | ml/mol | McGowan Calculated Property |
| Pc | 1633.81 | kPa | Joback Calculated Property |
| Inp | [1889.00; 1889.00] |
|
|
| Inp | 1889.00 | NIST | |
| Inp | 1889.00 | NIST | |
| Tboil | 732.06 | K | Joback Calculated Property |
| Tc | 933.91 | K | Joback Calculated Property |
| Tfus | 387.54 | K | Joback Calculated Property |
| Vc | 0.899 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [732.39; 830.10] | J/mol×K | [732.06; 933.91] |
|
| Cp,gas | 732.39 | J/mol×K | 732.06 | Joback Calculated Property |
| Cp,gas | 751.74 | J/mol×K | 765.70 | Joback Calculated Property |
| Cp,gas | 769.85 | J/mol×K | 799.34 | Joback Calculated Property |
| Cp,gas | 786.74 | J/mol×K | 832.99 | Joback Calculated Property |
| Cp,gas | 802.40 | J/mol×K | 866.63 | Joback Calculated Property |
| Cp,gas | 816.85 | J/mol×K | 900.27 | Joback Calculated Property |
| Cp,gas | 830.10 | J/mol×K | 933.91 | Joback Calculated Property |
| η | [0.0001020; 0.0021382] | Pa×s | [387.54; 732.06] |
|
| η | 0.0021382 | Pa×s | 387.54 | Joback Calculated Property |
| η | 0.0009283 | Pa×s | 444.96 | Joback Calculated Property |
| η | 0.0004877 | Pa×s | 502.38 | Joback Calculated Property |
| η | 0.0002924 | Pa×s | 559.80 | Joback Calculated Property |
| η | 0.0001928 | Pa×s | 617.22 | Joback Calculated Property |
| η | 0.0001365 | Pa×s | 674.64 | Joback Calculated Property |
| η | 0.0001020 | Pa×s | 732.06 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, ethyl 2-methylpent-3-yl ester.
Sources
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