- InChI
- InChI=1S/C15H24O4/c1-4-5-6-7-11-18-14(16)8-9-15(17)19-12-10-13(2)3/h4,10H,1,5-9,11-12H2,2-3H3
- InChI Key
- BEQVBLRBMJNWSE-UHFFFAOYSA-N
- Formula
- C15H24O4
- SMILES
- C=CCCCCOC(=O)CCC(=O)OCC=C(C)C
- Molecular Weight1
- 268.35
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- 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 | -790.31 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 40.96 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 81.89 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 3.175 | Crippen Calculated Property | |
| McVol | 228.490 | ml/mol | McGowan Calculated Property |
| Inp | 1864.00 | NIST | |
| Tboil | 586.27 | K | Relay (1.0) Calculated Property |
| Tfus | 251.20 | 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 | [618.08; 699.92] | J/mol×K | [659.96; 840.20] | 
|
| Cp,gas | 618.08 | J/mol×K | 659.96 | Joback Calculated Property |
| Cp,gas | 633.75 | J/mol×K | 690.00 | Joback Calculated Property |
| Cp,gas | 648.58 | J/mol×K | 720.04 | Joback Calculated Property |
| Cp,gas | 662.60 | J/mol×K | 750.08 | Joback Calculated Property |
| Cp,gas | 675.81 | J/mol×K | 780.12 | Joback Calculated Property |
| Cp,gas | 688.25 | J/mol×K | 810.16 | Joback Calculated Property |
| Cp,gas | 699.92 | J/mol×K | 840.20 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, 3-methylbut-2-en-1-yl hex-5-en-1-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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