- InChI
- InChI=1S/C23H42O4/c1-5-7-8-9-10-11-12-13-14-15-19-26-22(24)17-16-18-23(25)27-21(6-2)20(3)4/h14-15,20-21H,5-13,16-19H2,1-4H3/b15-14+
- InChI Key
- UAEFLMCRJQWYMD-CCEZHUSRSA-N
- Formula
- C23H42O4
- SMILES
-
CCCCCCCCCC=CCOC(=O)CCCC(=O)OC(
CC)C(C)C - Molecular Weight1
- 382.58
- 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).
- Tc : Critical 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 | -1072.14 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.22 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 105.37 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 6.375 | Crippen Calculated Property | |
| McVol | 345.510 | ml/mol | McGowan Calculated Property |
| Inp | [2540.00; 2540.00] |
|
|
| Inp | 2540.00 | NIST | |
| Inp | 2540.00 | NIST | |
| Tboil | 631.59 | K | Relay (1.0) Calculated Property |
| Tc | 807.70 | K | Relay (1.0) Calculated Property |
| Tfus | 250.98 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate 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 | [1111.23; 1207.73] | J/mol×K | [845.56; 1036.03] |
|
| Cp,gas | 1111.23 | J/mol×K | 845.56 | Joback Calculated Property |
| Cp,gas | 1130.29 | J/mol×K | 877.31 | Joback Calculated Property |
| Cp,gas | 1148.11 | J/mol×K | 909.05 | Joback Calculated Property |
| Cp,gas | 1164.73 | J/mol×K | 940.80 | Joback Calculated Property |
| Cp,gas | 1180.18 | J/mol×K | 972.54 | Joback Calculated Property |
| Cp,gas | 1194.50 | J/mol×K | 1004.29 | Joback Calculated Property |
| Cp,gas | 1207.73 | J/mol×K | 1036.03 | Joback Calculated Property |
| η | [0.0000194; 0.0015627] | Pa×s | [398.55; 845.56] |
|
| η | 0.0015627 | Pa×s | 398.55 | Joback Calculated Property |
| η | 0.0004229 | Pa×s | 473.05 | Joback Calculated Property |
| η | 0.0001633 | Pa×s | 547.55 | Joback Calculated Property |
| η | 0.0000792 | Pa×s | 622.05 | Joback Calculated Property |
| η | 0.0000449 | Pa×s | 696.56 | Joback Calculated Property |
| η | 0.0000284 | Pa×s | 771.06 | Joback Calculated Property |
| η | 0.0000194 | Pa×s | 845.56 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, dodec-2-en-1-yl 2-methylpent-3-yl 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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