- InChI
- InChI=1S/C15H26O4/c1-4-5-6-11-18-14(16)9-10-15(17)19-12-7-8-13(2)3/h4,13H,1,5-12H2,2-3H3
- InChI Key
- FSWBYSGFMLXPJX-UHFFFAOYSA-N
- Formula
- C15H26O4
- SMILES
- C=CCCCOC(=O)CCC(=O)OCCCC(C)C
- Molecular Weight1
- 270.37
- 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 | -884.44 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.54 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.82 | kJ/mol | Relay (1.0) Calculated Property |
| logPoct/wat | 3.255 | Crippen Calculated Property | |
| McVol | 232.790 | ml/mol | McGowan Calculated Property |
| Inp | [1802.00; 1802.00] |
|
|
| Inp | 1802.00 | NIST | |
| Inp | 1802.00 | NIST | |
| Tboil | 583.18 | K | Relay (1.0) Calculated Property |
| Tc | 739.91 | K | Relay (1.0) Calculated Property |
| Tfus | 246.44 | 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 | [640.31; 725.55] | J/mol×K | [655.48; 830.61] |
|
| Cp,gas | 640.31 | J/mol×K | 655.48 | Joback Calculated Property |
| Cp,gas | 656.55 | J/mol×K | 684.67 | Joback Calculated Property |
| Cp,gas | 671.96 | J/mol×K | 713.86 | Joback Calculated Property |
| Cp,gas | 686.56 | J/mol×K | 743.05 | Joback Calculated Property |
| Cp,gas | 700.35 | J/mol×K | 772.24 | Joback Calculated Property |
| Cp,gas | 713.34 | J/mol×K | 801.43 | Joback Calculated Property |
| Cp,gas | 725.55 | J/mol×K | 830.61 | Joback Calculated Property |
| η | [0.0000842; 0.0037618] | Pa×s | [326.71; 655.48] |
|
| η | 0.0037618 | Pa×s | 326.71 | Joback Calculated Property |
| η | 0.0012673 | Pa×s | 381.51 | Joback Calculated Property |
| η | 0.0005611 | Pa×s | 436.30 | Joback Calculated Property |
| η | 0.0002980 | Pa×s | 491.10 | Joback Calculated Property |
| η | 0.0001797 | Pa×s | 545.89 | Joback Calculated Property |
| η | 0.0001188 | Pa×s | 600.68 | Joback Calculated Property |
| η | 0.0000842 | Pa×s | 655.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Succinic acid, isohexyl pent-4-enyl 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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