- InChI
- InChI=1S/C22H30O4/c1-2-16-25-21(23)14-9-15-22(24)26-20(19-12-7-4-8-13-19)17-18-10-5-3-6-11-18/h4-5,7-8,10,12-13,18,20H,2-3,6,9,11,14-17H2,1H3
- InChI Key
- YDGKRZASURGGEY-UHFFFAOYSA-N
- Formula
- C22H30O4
- SMILES
-
CCCOC(=O)CCCC(=O)OC(CC1C=CCCC1
)c1ccccc1 - Molecular Weight1
- 358.47
- 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° | -169.10 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -643.66 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 41.88 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 85.49 | kJ/mol | Joback Calculated Property |
| log10WS | -5.83 | Crippen Calculated Property | |
| logPoct/wat | 5.141 | Crippen Calculated Property | |
| McVol | 296.800 | ml/mol | McGowan Calculated Property |
| Pc | 1415.44 | kPa | Joback Calculated Property |
| Inp | [2643.00; 2643.00] |
|
|
| Inp | 2643.00 | NIST | |
| Inp | 2643.00 | NIST | |
| Tboil | 900.29 | K | Joback Calculated Property |
| Tc | 1120.38 | K | Joback Calculated Property |
| Tfus | 501.58 | K | Joback Calculated Property |
| Vc | 1.121 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [964.11; 1040.73] | J/mol×K | [900.29; 1120.38] |
|
| Cp,gas | 964.11 | J/mol×K | 900.29 | Joback Calculated Property |
| Cp,gas | 980.50 | J/mol×K | 936.97 | Joback Calculated Property |
| Cp,gas | 995.38 | J/mol×K | 973.65 | Joback Calculated Property |
| Cp,gas | 1008.79 | J/mol×K | 1010.33 | Joback Calculated Property |
| Cp,gas | 1020.79 | J/mol×K | 1047.02 | Joback Calculated Property |
| Cp,gas | 1031.42 | J/mol×K | 1083.70 | Joback Calculated Property |
| Cp,gas | 1040.73 | J/mol×K | 1120.38 | Joback Calculated Property |
| η | [0.0000416; 0.0007124] | Pa×s | [501.58; 900.29] |
|
| η | 0.0007124 | Pa×s | 501.58 | Joback Calculated Property |
| η | 0.0003363 | Pa×s | 568.03 | Joback Calculated Property |
| η | 0.0001858 | Pa×s | 634.48 | Joback Calculated Property |
| η | 0.0001149 | Pa×s | 700.93 | Joback Calculated Property |
| η | 0.0000772 | Pa×s | 767.39 | Joback Calculated Property |
| η | 0.0000553 | Pa×s | 833.84 | Joback Calculated Property |
| η | 0.0000416 | Pa×s | 900.29 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 1-phenyl-2-(3-cyclohexenyl)ethyl propyl ester.
Sources
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