- InChI
- InChI=1S/C25H36O4/c1-2-3-4-11-19-28-24(26)17-12-18-25(27)29-23(22-15-9-6-10-16-22)20-21-13-7-5-8-14-21/h6-7,9-10,13,15-16,21,23H,2-5,8,11-12,14,17-20H2,1H3
- InChI Key
- PSJOUSUPSUILOT-UHFFFAOYSA-N
- Formula
- C25H36O4
- SMILES
-
CCCCCCOC(=O)CCCC(=O)OC(CC1C=CC
CC1)c1ccccc1 - Molecular Weight1
- 400.55
- 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° | -143.84 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -705.58 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 49.65 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.17 | kJ/mol | Joback Calculated Property |
| log10WS | -7.08 | Crippen Calculated Property | |
| logPoct/wat | 6.311 | Crippen Calculated Property | |
| McVol | 339.070 | ml/mol | McGowan Calculated Property |
| Pc | 1152.22 | kPa | Joback Calculated Property |
| Inp | 2945.00 | NIST | |
| Tboil | 968.93 | K | Joback Calculated Property |
| Tc | 1191.22 | K | Joback Calculated Property |
| Tfus | 535.39 | K | Joback Calculated Property |
| Vc | 1.288 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1146.22; 1220.69] | J/mol×K | [968.93; 1191.22] | 
|
| Cp,gas | 1146.22 | J/mol×K | 968.93 | Joback Calculated Property |
| Cp,gas | 1162.44 | J/mol×K | 1005.98 | Joback Calculated Property |
| Cp,gas | 1177.05 | J/mol×K | 1043.03 | Joback Calculated Property |
| Cp,gas | 1190.12 | J/mol×K | 1080.07 | Joback Calculated Property |
| Cp,gas | 1201.71 | J/mol×K | 1117.12 | Joback Calculated Property |
| Cp,gas | 1211.88 | J/mol×K | 1154.17 | Joback Calculated Property |
| Cp,gas | 1220.69 | J/mol×K | 1191.22 | Joback Calculated Property |
| η | [0.0000266; 0.0004953] | Pa×s | [535.39; 968.93] |
|
| η | 0.0004953 | Pa×s | 535.39 | Joback Calculated Property |
| η | 0.0002276 | Pa×s | 607.65 | Joback Calculated Property |
| η | 0.0001234 | Pa×s | 679.90 | Joback Calculated Property |
| η | 0.0000752 | Pa×s | 752.16 | Joback Calculated Property |
| η | 0.0000500 | Pa×s | 824.42 | Joback Calculated Property |
| η | 0.0000355 | Pa×s | 896.67 | Joback Calculated Property |
| η | 0.0000266 | Pa×s | 968.93 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hexyl 1-phenyl-2-(3-cyclohexenyl)ethyl ester.
Sources
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