- InChI
- InChI=1S/C24H40O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24(25)26-2/h3-11,16-23H2,1-2H3
- InChI Key
- BZHUUTOAKXXTMA-UHFFFAOYSA-N
- Formula
- C24H40O2
- SMILES
-
CCCCCCCCCCC#CC#CCCCCCCCCC(=O)O
C - Molecular Weight1
- 360.57
- 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 | 0.8931 | Relay (1.0) Calculated Property | |
| ΔfG° | 322.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -302.02 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 66.95 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 119.26 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.03 | eV | Relay (1.0) Calculated Property |
| log10WS | -7.38 | Relay (1.0) Calculated Property | |
| logPoct/wat | 6.818 | Crippen Calculated Property | |
| McVol | 339.260 | ml/mol | McGowan Calculated Property |
| Pc | 1003.98 | kPa | Joback Calculated Property |
| Inp | [2832.30; 2832.30] |
|
|
| Inp | 2832.30 | NIST | |
| Inp | 2832.30 | NIST | |
| Tboil | 611.86 | K | Relay (1.0) Calculated Property |
| Tc | 809.80 | K | Relay (1.0) Calculated Property |
| Tfus | 321.66 | K | Relay (1.0) Calculated Property |
| Vc | 1.269 | m3/kmol | Relay (1.0) Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1057.94; 1159.76] | J/mol×K | [842.81; 1038.10] |
|
| Cp,gas | 1057.94 | J/mol×K | 842.81 | Joback Calculated Property |
| Cp,gas | 1077.58 | J/mol×K | 875.36 | Joback Calculated Property |
| Cp,gas | 1096.10 | J/mol×K | 907.91 | Joback Calculated Property |
| Cp,gas | 1113.55 | J/mol×K | 940.45 | Joback Calculated Property |
| Cp,gas | 1129.95 | J/mol×K | 973.00 | Joback Calculated Property |
| Cp,gas | 1145.34 | J/mol×K | 1005.55 | Joback Calculated Property |
| Cp,gas | 1159.76 | J/mol×K | 1038.10 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to 10,12-Tricosadiynoic acid, methyl ester.
Sources
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