- InChI
- InChI=1S/C23H34O5/c1-4-5-6-7-8-9-11-18(2)27-22(25)12-10-13-23(26)28-21-16-14-20(15-17-21)19(3)24/h14-18H,4-13H2,1-3H3
- InChI Key
- XWBUAKSNOZBJDB-UHFFFAOYSA-N
- Formula
- C23H34O5
- SMILES
-
CCCCCCCCC(C)OC(=O)CCCC(=O)Oc1c
cc(C(C)=O)cc1 - Molecular Weight1
- 390.51
- 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 | -1044.30 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 55.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.01 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.647 | Crippen Calculated Property | |
| McVol | 327.620 | ml/mol | McGowan Calculated Property |
| Inp | [2901.00; 2901.00] |
|
|
| Inp | 2901.00 | NIST | |
| Inp | 2901.00 | NIST | |
| Tboil | 665.24 | K | Relay (1.0) Calculated Property |
| Tfus | 321.24 | 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 | [1060.70; 1129.67] | J/mol×K | [927.37; 1137.50] |
|
| Cp,gas | 1060.70 | J/mol×K | 927.37 | Joback Calculated Property |
| Cp,gas | 1075.66 | J/mol×K | 962.39 | Joback Calculated Property |
| Cp,gas | 1089.19 | J/mol×K | 997.41 | Joback Calculated Property |
| Cp,gas | 1101.31 | J/mol×K | 1032.44 | Joback Calculated Property |
| Cp,gas | 1112.08 | J/mol×K | 1067.46 | Joback Calculated Property |
| Cp,gas | 1121.52 | J/mol×K | 1102.48 | Joback Calculated Property |
| Cp,gas | 1129.67 | J/mol×K | 1137.50 | Joback Calculated Property |
| η | [0.0000234; 0.0005415] | Pa×s | [507.50; 927.37] |
|
| η | 0.0005415 | Pa×s | 507.50 | Joback Calculated Property |
| η | 0.0002336 | Pa×s | 577.48 | Joback Calculated Property |
| η | 0.0001208 | Pa×s | 647.46 | Joback Calculated Property |
| η | 0.0000711 | Pa×s | 717.43 | Joback Calculated Property |
| η | 0.0000459 | Pa×s | 787.41 | Joback Calculated Property |
| η | 0.0000319 | Pa×s | 857.39 | Joback Calculated Property |
| η | 0.0000234 | Pa×s | 927.37 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, dec-2-yl 4-acetylphenyl 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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