- InChI
- InChI=1S/C22H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22(23)24-2/h8-9,11-12H,3-7,10,13-21H2,1-2H3/b9-8+,12-11+
- InChI Key
- VPVGSRIJUIEFPI-MVKOLZDDSA-N
- Formula
- C22H40O2
- SMILES
-
CCCCCC/C=C/C/C=C/CCCCCCCCCC(=O
)OC - Molecular Weight1
- 336.56
- 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 | 0.8605 | Relay (1.0) Calculated Property | |
| ΔfG° | -15.57 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -634.03 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 57.51 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.02 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 8.80 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.08 | Relay (1.0) Calculated Property | |
| logPoct/wat | 7.143 | Crippen Calculated Property | |
| McVol | 319.680 | ml/mol | McGowan Calculated Property |
| Pc | 963.87 | kPa | Joback Calculated Property |
| Inp | [2118.00; 2118.00] |
|
|
| Inp | 2118.00 | NIST | |
| Inp | 2118.00 | NIST | |
| Inp | 2118.00 | NIST | |
| Tboil | 602.77 | K | Relay (1.0) Calculated Property |
| Tc | 796.50 | K | Relay (1.0) Calculated Property |
| Tfus | 281.53 | K | Relay (1.0) Calculated Property |
| Vc | 1.170 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [973.32; 1076.68] | J/mol×K | [769.50; 947.95] |
|
| Cp,gas | 973.32 | J/mol×K | 769.50 | Joback Calculated Property |
| Cp,gas | 992.85 | J/mol×K | 799.24 | Joback Calculated Property |
| Cp,gas | 1011.40 | J/mol×K | 828.98 | Joback Calculated Property |
| Cp,gas | 1029.01 | J/mol×K | 858.73 | Joback Calculated Property |
| Cp,gas | 1045.73 | J/mol×K | 888.47 | Joback Calculated Property |
| Cp,gas | 1061.60 | J/mol×K | 918.21 | Joback Calculated Property |
| Cp,gas | 1076.68 | J/mol×K | 947.95 | Joback Calculated Property |
| η | [0.0000372; 0.0017035] | Pa×s | [369.87; 769.50] |
|
| η | 0.0017035 | Pa×s | 369.87 | Joback Calculated Property |
| η | 0.0005537 | Pa×s | 436.48 | Joback Calculated Property |
| η | 0.0002423 | Pa×s | 503.08 | Joback Calculated Property |
| η | 0.0001287 | Pa×s | 569.68 | Joback Calculated Property |
| η | 0.0000780 | Pa×s | 636.29 | Joback Calculated Property |
| η | 0.0000520 | Pa×s | 702.89 | Joback Calculated Property |
| η | 0.0000372 | Pa×s | 769.50 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Methyl 11,14-eicosadienoate.
Sources
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