- InChI
- InChI=1S/C15H26O4/c1-4-5-6-11-18-14(16)8-7-9-15(17)19-12-10-13(2)3/h10H,4-9,11-12H2,1-3H3
- InChI Key
- KNPAAUCSSPQEBZ-UHFFFAOYSA-N
- Formula
- C15H26O4
- SMILES
- CCCCCOC(=O)CCCC(=O)OCC=C(C)C
- Molecular Weight1
- 270.36
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- ΔfG° : Standard Gibbs free energy of formation (kJ/mol).
- 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).
- log10WS : Log10 of Water solubility in mol/l.
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Inp : Non-polar retention indices.
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- Vc : Critical Volume (m3/kmol).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ΔfG° | -320.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -735.10 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 39.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 67.33 | kJ/mol | Joback Calculated Property |
| log10WS | -3.68 | Crippen Calculated Property | |
| logPoct/wat | 3.399 | Crippen Calculated Property | |
| McVol | 232.790 | ml/mol | McGowan Calculated Property |
| Pc | 1588.54 | kPa | Joback Calculated Property |
| Inp | [1904.00; 1904.00] |
|
|
| Inp | 1904.00 | NIST | |
| Inp | 1904.00 | NIST | |
| Tboil | 699.22 | K | Joback Calculated Property |
| Tc | 881.91 | K | Joback Calculated Property |
| Tfus | 384.09 | K | Joback Calculated Property |
| Vc | 0.904 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [654.34; 737.48] | J/mol×K | [699.22; 881.91] |
|
| Cp,gas | 654.34 | J/mol×K | 699.22 | Joback Calculated Property |
| Cp,gas | 670.11 | J/mol×K | 729.67 | Joback Calculated Property |
| Cp,gas | 685.10 | J/mol×K | 760.12 | Joback Calculated Property |
| Cp,gas | 699.32 | J/mol×K | 790.57 | Joback Calculated Property |
| Cp,gas | 712.77 | J/mol×K | 821.02 | Joback Calculated Property |
| Cp,gas | 725.49 | J/mol×K | 851.47 | Joback Calculated Property |
| Cp,gas | 737.48 | J/mol×K | 881.91 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Glutaric acid, 3-methylbut-2-enyl pentyl ester.
Sources
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