- InChI
- InChI=1S/C24H30O4/c1-3-4-6-10-19(2)27-23(25)13-9-14-24(26)28-22-17-15-21(16-18-22)20-11-7-5-8-12-20/h5,7-8,11-12,15-19H,3-4,6,9-10,13-14H2,1-2H3
- InChI Key
- MXRSAKRMUBSTES-UHFFFAOYSA-N
- Formula
- C24H30O4
- SMILES
-
CCCCCC(C)OC(=O)CCCC(=O)Oc1ccc(
-c2ccccc2)cc1 - Molecular Weight1
- 382.49
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -710.57 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 47.66 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 118.36 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.941 | Crippen Calculated Property | |
| McVol | 316.380 | ml/mol | McGowan Calculated Property |
| Inp | [2947.00; 2947.00] |
|
|
| Inp | 2947.00 | NIST | |
| Inp | 2947.00 | NIST | |
| Tboil | 697.08 | K | Relay (1.0) Calculated Property |
| Tfus | 338.76 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Temperature, Critical Pressure, Critical Volume, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1017.17; 1084.02] | J/mol×K | [959.00; 1183.19] |
|
| Cp,gas | 1017.17 | J/mol×K | 959.00 | Joback Calculated Property |
| Cp,gas | 1031.66 | J/mol×K | 996.37 | Joback Calculated Property |
| Cp,gas | 1044.74 | J/mol×K | 1033.73 | Joback Calculated Property |
| Cp,gas | 1056.47 | J/mol×K | 1071.10 | Joback Calculated Property |
| Cp,gas | 1066.89 | J/mol×K | 1108.46 | Joback Calculated Property |
| Cp,gas | 1076.05 | J/mol×K | 1145.83 | Joback Calculated Property |
| Cp,gas | 1084.02 | J/mol×K | 1183.19 | Joback Calculated Property |
| η | [0.0000290; 0.0003715] | Pa×s | [554.92; 959.00] |
|
| η | 0.0003715 | Pa×s | 554.92 | Joback Calculated Property |
| η | 0.0001929 | Pa×s | 622.27 | Joback Calculated Property |
| η | 0.0001139 | Pa×s | 689.61 | Joback Calculated Property |
| η | 0.0000738 | Pa×s | 756.96 | Joback Calculated Property |
| η | 0.0000514 | Pa×s | 824.31 | Joback Calculated Property |
| η | 0.0000377 | Pa×s | 891.65 | Joback Calculated Property |
| η | 0.0000290 | Pa×s | 959.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hept-2-yl 4-biphenyl ester.
Sources
- Cheméo Relay (1.0)
- Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
- Crippen Method
- Crippen Method
- Joback Method
- McGowan Method
- NIST Webbook
Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more.
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