- InChI
- InChI=1S/C15H26O4/c1-4-5-8-11-18-14(16)9-6-7-10-15(17)19-12-13(2)3/h4,13H,1,5-12H2,2-3H3
- InChI Key
- JCBQGTWLNVAALE-UHFFFAOYSA-N
- Formula
- C15H26O4
- SMILES
- C=CCCCOC(=O)CCCCC(=O)OCC(C)C
- Molecular Weight1
- 270.36
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- 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).
- IE : Ionization energy (eV).
- 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 |
|---|---|---|---|
| ω | 0.8006 | Relay (1.0) Calculated Property | |
| ΔfG° | -307.02 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -889.74 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 35.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 76.52 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.39 | eV | Relay (1.0) Calculated Property |
| log10WS | -3.16 | Relay (1.0) Calculated Property | |
| logPoct/wat | 3.255 | Crippen Calculated Property | |
| McVol | 232.790 | ml/mol | McGowan Calculated Property |
| Pc | 1579.71 | kPa | Joback Calculated Property |
| Inp | [1807.00; 1807.00] |
|
|
| Inp | 1807.00 | NIST | |
| Inp | 1807.00 | NIST | |
| Tboil | 582.29 | K | Relay (1.0) Calculated Property |
| Tc | 732.30 | K | Relay (1.0) Calculated Property |
| Tfus | 246.24 | K | Relay (1.0) Calculated Property |
| Vc | 0.867 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [653.86; 737.18] | J/mol×K | [691.42; 871.43] |
|
| Cp,gas | 653.86 | J/mol×K | 691.42 | Joback Calculated Property |
| Cp,gas | 669.68 | J/mol×K | 721.42 | Joback Calculated Property |
| Cp,gas | 684.71 | J/mol×K | 751.42 | Joback Calculated Property |
| Cp,gas | 698.97 | J/mol×K | 781.43 | Joback Calculated Property |
| Cp,gas | 712.46 | J/mol×K | 811.43 | Joback Calculated Property |
| Cp,gas | 725.19 | J/mol×K | 841.43 | Joback Calculated Property |
| Cp,gas | 737.18 | J/mol×K | 871.43 | Joback Calculated Property |
| η | [0.0001030; 0.0016556] | Pa×s | [386.37; 691.42] |
|
| η | 0.0016556 | Pa×s | 386.37 | Joback Calculated Property |
| η | 0.0007963 | Pa×s | 437.21 | Joback Calculated Property |
| η | 0.0004461 | Pa×s | 488.05 | Joback Calculated Property |
| η | 0.0002788 | Pa×s | 538.89 | Joback Calculated Property |
| η | 0.0001889 | Pa×s | 589.74 | Joback Calculated Property |
| η | 0.0001362 | Pa×s | 640.58 | Joback Calculated Property |
| η | 0.0001030 | Pa×s | 691.42 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Adipic acid, isobutyl pent-4-enyl ester.
Sources
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