- InChI
- InChI=1S/C22H38O4/c1-5-7-12-18(6-2)16-26-22(24)20-14-9-8-13-19(20)21(23)25-15-10-11-17(3)4/h8-9,17-20H,5-7,10-16H2,1-4H3
- InChI Key
- FVCVEJYVDPWSDB-UHFFFAOYSA-N
- Formula
- C22H38O4
- SMILES
-
CCCCC(CC)COC(=O)C1CC=CCC1C(=O)
OCCCC(C)C - Molecular Weight1
- 366.53
- 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 | 0.8250 | Relay (... Calculated Property | |
| ΔfG° | -291.66 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -984.06 | kJ/mol | Relay (... Calculated Property |
| ΔfusH° | 45.39 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.51 | kJ/mol | Relay (... Calculated Property |
| IE | 9.05 | eV | Relay (... Calculated Property |
| log10WS | -5.47 | Relay (... Calculated Property | |
| logPoct/wat | 5.308 | Crippen Calculated Property | |
| McVol | 320.560 | ml/mol | McGowan Calculated Property |
| Pc | 1100.81 | kPa | Joback Calculated Property |
| Inp | 2360.00 | NIST | |
| Tboil | 632.36 | K | Relay (... Calculated Property |
| Tc | 821.70 | K | Relay (... Calculated Property |
| Tfus | 259.66 | K | Relay (... Calculated Property |
| Vc | 1.147 | m3/kmol | Relay (... Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1064.89; 1157.31] | J/mol×K | [868.50; 1070.02] | 
|
| Cp,gas | 1064.89 | J/mol×K | 868.50 | Joback Calculated Property |
| Cp,gas | 1083.83 | J/mol×K | 902.09 | Joback Calculated Property |
| Cp,gas | 1101.33 | J/mol×K | 935.67 | Joback Calculated Property |
| Cp,gas | 1117.40 | J/mol×K | 969.26 | Joback Calculated Property |
| Cp,gas | 1132.07 | J/mol×K | 1002.85 | Joback Calculated Property |
| Cp,gas | 1145.36 | J/mol×K | 1036.44 | Joback Calculated Property |
| Cp,gas | 1157.31 | J/mol×K | 1070.02 | Joback Calculated Property |
| η | [0.0000484; 0.0010737] | Pa×s | [455.92; 868.50] |
|
| η | 0.0010737 | Pa×s | 455.92 | Joback Calculated Property |
| η | 0.0004565 | Pa×s | 524.68 | Joback Calculated Property |
| η | 0.0002367 | Pa×s | 593.45 | Joback Calculated Property |
| η | 0.0001406 | Pa×s | 662.21 | Joback Calculated Property |
| η | 0.0000922 | Pa×s | 730.97 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 799.74 | Joback Calculated Property |
| η | 0.0000484 | Pa×s | 868.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2-ethylhexyl isohexyl ester.
Sources
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