- InChI
- InChI=1S/C14H24O2/c1-4-6-7-8-9-10-11-12-16-14(15)13(3)5-2/h5,9-10H,4,6-8,11-12H2,1-3H3/b10-9-,13-5+
- InChI Key
- PHYVRJBNPCQLHO-RBUNJRTFSA-N
- Formula
- C14H24O2
- SMILES
- CC=C(C)C(=O)OCCC=CCCCCC
- Molecular Weight1
- 224.34
- 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° | -15.03 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -352.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.90 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 55.91 | kJ/mol | Joback Calculated Property |
| log10WS | -4.25 | Crippen Calculated Property | |
| logPoct/wat | 4.022 | Crippen Calculated Property | |
| McVol | 206.960 | ml/mol | McGowan Calculated Property |
| Pc | 1726.03 | kPa | Joback Calculated Property |
| Inp | [1612.00; 1612.00] |
|
|
| Inp | 1612.00 | NIST | |
| Inp | 1612.00 | NIST | |
| Tboil | 604.21 | K | Joback Calculated Property |
| Tc | 787.04 | K | Joback Calculated Property |
| Tfus | 295.58 | K | Joback Calculated Property |
| Vc | 0.804 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [527.38; 614.21] | J/mol×K | [604.21; 787.04] |
|
| Cp,gas | 527.38 | J/mol×K | 604.21 | Joback Calculated Property |
| Cp,gas | 543.69 | J/mol×K | 634.68 | Joback Calculated Property |
| Cp,gas | 559.23 | J/mol×K | 665.15 | Joback Calculated Property |
| Cp,gas | 574.01 | J/mol×K | 695.62 | Joback Calculated Property |
| Cp,gas | 588.08 | J/mol×K | 726.10 | Joback Calculated Property |
| Cp,gas | 601.47 | J/mol×K | 756.57 | Joback Calculated Property |
| Cp,gas | 614.21 | J/mol×K | 787.04 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to (Z)-Non-3-enyl (E)-2-methylbut-2-enoate.
Sources
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