- InChI
- InChI=1S/C18H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20-4-2/h7-8H,3-6,9-17H2,1-2H3/b8-7+
- InChI Key
- ORDVGMQAZDTLDF-BQYQJAHWSA-N
- Formula
- C18H34O2
- SMILES
- CCCCC=CCCCCCCCCCC(=O)OCC
- Molecular Weight1
- 282.46
- Other Names
-
- Ethyl E-11-hexadecenoate
- Ethyl ester E-11 hexadecenoic acid
- 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.
- I : 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 | 0.8097 | Relay (1.0) Calculated Property | |
| ΔfG° | -129.47 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -673.13 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 46.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 94.00 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.83 | eV | Relay (1.0) Calculated Property |
| log10WS | -5.81 | Relay (1.0) Calculated Property | |
| logPoct/wat | 5.807 | Crippen Calculated Property | |
| McVol | 267.620 | ml/mol | McGowan Calculated Property |
| Pc | 1198.13 | kPa | Joback Calculated Property |
| Inp | [1974.00; 1974.00] |
|
|
| Inp | 1974.00 | NIST | |
| Inp | 1974.00 | NIST | |
| I | 2236.00 | NIST | |
| Tboil | 579.08 | K | Relay (1.0) Calculated Property |
| Tc | 757.04 | K | Relay (1.0) Calculated Property |
| Tfus | 261.73 | K | Relay (1.0) Calculated Property |
| Vc | 1.016 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [759.38; 858.05] | J/mol×K | [673.82; 843.69] |
|
| Cp,gas | 759.38 | J/mol×K | 673.82 | Joback Calculated Property |
| Cp,gas | 777.89 | J/mol×K | 702.13 | Joback Calculated Property |
| Cp,gas | 795.54 | J/mol×K | 730.44 | Joback Calculated Property |
| Cp,gas | 812.35 | J/mol×K | 758.75 | Joback Calculated Property |
| Cp,gas | 828.36 | J/mol×K | 787.06 | Joback Calculated Property |
| Cp,gas | 843.58 | J/mol×K | 815.37 | Joback Calculated Property |
| Cp,gas | 858.05 | J/mol×K | 843.69 | Joback Calculated Property |
| η | [0.0000738; 0.0028946] | Pa×s | [329.87; 673.82] |
|
| η | 0.0028946 | Pa×s | 329.87 | Joback Calculated Property |
| η | 0.0009986 | Pa×s | 387.19 | Joback Calculated Property |
| η | 0.0004533 | Pa×s | 444.52 | Joback Calculated Property |
| η | 0.0002465 | Pa×s | 501.84 | Joback Calculated Property |
| η | 0.0001518 | Pa×s | 559.17 | Joback Calculated Property |
| η | 0.0001024 | Pa×s | 616.49 | Joback Calculated Property |
| η | 0.0000738 | Pa×s | 673.82 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to E-11-Hexadecenoic acid, ethyl ester.
Sources
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