- InChI
- InChI=1S/C20H36O4/c1-5-7-9-11-14-18(4)24-20(22)16-12-15-19(21)23-17(3)13-10-8-6-2/h11,14,17-18H,5-10,12-13,15-16H2,1-4H3/b14-11+
- InChI Key
- UEKDXXKKISRDQU-SDNWHVSQSA-N
- Formula
- C20H36O4
- SMILES
-
CCCC/C=C/C(C)OC(=O)CCCC(=O)OC(
C)CCCCC - Molecular Weight1
- 340.50
- 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 | -1013.79 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 49.45 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 95.16 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 5.347 | Crippen Calculated Property | |
| McVol | 303.240 | ml/mol | McGowan Calculated Property |
| Inp | [2132.00; 2132.00] |
|
|
| Inp | 2132.00 | NIST | |
| Inp | 2132.00 | NIST | |
| Tboil | 580.47 | K | Relay (1.0) Calculated Property |
| Tc | 767.13 | K | Relay (1.0) Calculated Property |
| Tfus | 243.83 | 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 | [928.66; 1021.80] | J/mol×K | [776.92; 959.12] |
|
| Cp,gas | 928.66 | J/mol×K | 776.92 | Joback Calculated Property |
| Cp,gas | 946.77 | J/mol×K | 807.29 | Joback Calculated Property |
| Cp,gas | 963.81 | J/mol×K | 837.65 | Joback Calculated Property |
| Cp,gas | 979.80 | J/mol×K | 868.02 | Joback Calculated Property |
| Cp,gas | 994.78 | J/mol×K | 898.39 | Joback Calculated Property |
| Cp,gas | 1008.77 | J/mol×K | 928.75 | Joback Calculated Property |
| Cp,gas | 1021.80 | J/mol×K | 959.12 | Joback Calculated Property |
| η | [0.0000309; 0.0025134] | Pa×s | [364.74; 776.92] |
|
| η | 0.0025134 | Pa×s | 364.74 | Joback Calculated Property |
| η | 0.0006752 | Pa×s | 433.44 | Joback Calculated Property |
| η | 0.0002599 | Pa×s | 502.13 | Joback Calculated Property |
| η | 0.0001259 | Pa×s | 570.83 | Joback Calculated Property |
| η | 0.0000712 | Pa×s | 639.53 | Joback Calculated Property |
| η | 0.0000450 | Pa×s | 708.22 | Joback Calculated Property |
| η | 0.0000309 | Pa×s | 776.92 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, hept-2-yl oct-3-en-2-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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