- InChI
- InChI=1S/C16H26O4/c1-4-19-15(17)13-9-5-6-10-14(13)16(18)20-11-7-8-12(2)3/h5-6,12-14H,4,7-11H2,1-3H3
- InChI Key
- FQLHTDJFRLGLAW-UHFFFAOYSA-N
- Formula
- C16H26O4
- SMILES
-
CCOC(=O)C1CC=CCC1C(=O)OCCCC(C)
C - Molecular Weight1
- 282.38
- ω : Acentric Factor.
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.6387 | Relay (... Calculated Property | |
| ΔfG° | -339.74 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -839.35 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 33.37 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 83.60 | kJ/mol | Relay (... Calculated Property |
| IE | 9.10 | eV | Relay (... Calculated Property |
| log10WS | -3.77 | Relay (... Calculated Property | |
| logPoct/wat | 3.111 | Crippen Calculated Property | |
| McVol | 236.020 | ml/mol | McGowan Calculated Property |
| Pc | 1671.43 | kPa | Joback Calculated Property |
| Inp | 1877.00 | NIST | |
| Tboil | 577.49 | K | Relay (... Calculated Property |
| Tc | 767.87 | K | Relay (... Calculated Property |
| Tfus | 282.80 | K | Relay (... Calculated Property |
| Vc | 0.842 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [706.67; 798.70] | J/mol×K | [731.66; 931.82] | 
|
| Cp,gas | 706.67 | J/mol×K | 731.66 | Joback Calculated Property |
| Cp,gas | 724.87 | J/mol×K | 765.02 | Joback Calculated Property |
| Cp,gas | 741.91 | J/mol×K | 798.38 | Joback Calculated Property |
| Cp,gas | 757.81 | J/mol×K | 831.74 | Joback Calculated Property |
| Cp,gas | 772.57 | J/mol×K | 865.10 | Joback Calculated Property |
| Cp,gas | 786.20 | J/mol×K | 898.46 | Joback Calculated Property |
| Cp,gas | 798.70 | J/mol×K | 931.82 | Joback Calculated Property |
| η | [0.0001171; 0.0016405] | Pa×s | [403.30; 731.66] |
|
| η | 0.0016405 | Pa×s | 403.30 | Joback Calculated Property |
| η | 0.0008124 | Pa×s | 458.03 | Joback Calculated Property |
| η | 0.0004674 | Pa×s | 512.75 | Joback Calculated Property |
| η | 0.0002992 | Pa×s | 567.48 | Joback Calculated Property |
| η | 0.0002071 | Pa×s | 622.21 | Joback Calculated Property |
| η | 0.0001522 | Pa×s | 676.93 | Joback Calculated Property |
| η | 0.0001171 | Pa×s | 731.66 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, ethyl isohexyl ester.
Sources
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