- InChI
- InChI=1S/C23H36O6/c1-5-6-7-8-9-10-13-18(2)28-21(24)16-12-17-22(25)29-23-19(26-3)14-11-15-20(23)27-4/h11,14-15,18H,5-10,12-13,16-17H2,1-4H3
- InChI Key
- QYAPQJYBUCHKQI-UHFFFAOYSA-N
- Formula
- C23H36O6
- SMILES
-
CCCCCCCCC(C)OC(=O)CCCC(=O)Oc1c
(OC)cccc1OC - Molecular Weight1
- 408.53
- 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).
- 1: Molecular weight from the IUPAC atomic weights tables.
Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfH°gas | -1132.99 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 56.18 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 113.68 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.462 | Crippen Calculated Property | |
| McVol | 337.790 | ml/mol | McGowan Calculated Property |
| Inp | [2839.00; 2839.00] |
|
|
| Inp | 2839.00 | NIST | |
| Inp | 2839.00 | NIST | |
| Tboil | 666.93 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Normal melting (fusion) point, 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 | [1102.76; 1171.96] | J/mol×K | [923.32; 1131.16] |
|
| Cp,gas | 1102.76 | J/mol×K | 923.32 | Joback Calculated Property |
| Cp,gas | 1118.34 | J/mol×K | 957.96 | Joback Calculated Property |
| Cp,gas | 1132.30 | J/mol×K | 992.60 | Joback Calculated Property |
| Cp,gas | 1144.64 | J/mol×K | 1027.24 | Joback Calculated Property |
| Cp,gas | 1155.36 | J/mol×K | 1061.88 | Joback Calculated Property |
| Cp,gas | 1164.46 | J/mol×K | 1096.52 | Joback Calculated Property |
| Cp,gas | 1171.96 | J/mol×K | 1131.16 | Joback Calculated Property |
| η | [0.0000139; 0.0002742] | Pa×s | [514.55; 923.32] |
|
| η | 0.0002742 | Pa×s | 514.55 | Joback Calculated Property |
| η | 0.0001247 | Pa×s | 582.68 | Joback Calculated Property |
| η | 0.0000669 | Pa×s | 650.81 | Joback Calculated Property |
| η | 0.0000403 | Pa×s | 718.93 | Joback Calculated Property |
| η | 0.0000266 | Pa×s | 787.06 | Joback Calculated Property |
| η | 0.0000187 | Pa×s | 855.19 | Joback Calculated Property |
| η | 0.0000139 | Pa×s | 923.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, dec-2-yl 2,6-dimethoxyphenyl 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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