- InChI
- InChI=1S/C15H26O2/c1-4-6-7-8-9-10-11-12-13-17-15(16)14(3)5-2/h5,9-10H,4,6-8,11-13H2,1-3H3/b10-9-,14-5+
- InChI Key
- GNDJJJRLHIKVRW-DVBADTPPSA-N
- Formula
- C15H26O2
- SMILES
- C/C=C(\C)C(=O)OCCC/C=C\CCCCC
- Molecular Weight1
- 238.37
- ω : Acentric Factor.
- 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).
- 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 | 0.6471 | Relay (1.0) Calculated Property | |
| ΔfG° | -83.06 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -493.43 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 38.07 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.07 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.72 | eV | Relay (1.0) Calculated Property |
| log10WS | -4.81 | Relay (1.0) Calculated Property | |
| logPoct/wat | 4.412 | Crippen Calculated Property | |
| McVol | 221.050 | ml/mol | McGowan Calculated Property |
| Pc | 1545.13 | kPa | Joback Calculated Property |
| Inp | 1703.00 | NIST | |
| Tboil | 542.26 | K | Relay (1.0) Calculated Property |
| Tc | 736.68 | K | Relay (1.0) Calculated Property |
| Tfus | 210.16 | K | Relay (1.0) Calculated Property |
| Vc | 0.797 | m3/kmol | Relay (1.0) Calculated Property |
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [312.17; 739.87] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -1.33930e+01 | |||
| Coefficient B | 1.41396e+00 | |||
| Coefficient C | -8.67500e-04 | |||
| Coefficient D | 2.06800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 312.17 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 387.42 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 454.20 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 513.19 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 565.03 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 610.37 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 649.87 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 684.18 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 713.96 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 739.87 | J/mol×K | 1000.00 | Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-Dec-4-enyl (E)-2-methylbut-2-enoate.
Sources
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