- InChI
- InChI=1S/C36H68O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-38-36(37)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19H,3-10,12,14-16,18,20-35H2,1-2H3/b13-11+,19-17+
- InChI Key
- GYQHSCDMKLFUOQ-GRAPOSQESA-N
- Formula
- C36H68O2
- SMILES
-
CCCCCC=CCC=CCCCCCCCCOC(=O)CCCC
CCCCCCCCCCCCC - Molecular Weight1
- 532.92
- 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).
- 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° | 178.76 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -796.73 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 92.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 104.80 | kJ/mol | Joback Calculated Property |
| log10WS | -13.46 | Crippen Calculated Property | |
| logPoct/wat | 12.605 | Crippen Calculated Property | |
| McVol | 516.940 | ml/mol | McGowan Calculated Property |
| Pc | 488.60 | kPa | Joback Calculated Property |
| Inp | [3717.06; 3717.06] |
|
|
| Inp | 3717.06 | NIST | |
| Inp | 3717.06 | NIST | |
| Tboil | 1107.69 | K | Joback Calculated Property |
| Tc | 1426.10 | K | Joback Calculated Property |
| Tfus | 557.48 | K | Joback Calculated Property |
| Vc | 2.035 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1899.39; 2072.61] | J/mol×K | [1107.69; 1426.10] |
|
| Cp,gas | 1899.39 | J/mol×K | 1107.69 | Joback Calculated Property |
| Cp,gas | 1932.72 | J/mol×K | 1160.76 | Joback Calculated Property |
| Cp,gas | 1963.73 | J/mol×K | 1213.83 | Joback Calculated Property |
| Cp,gas | 1992.82 | J/mol×K | 1266.90 | Joback Calculated Property |
| Cp,gas | 2020.40 | J/mol×K | 1319.96 | Joback Calculated Property |
| Cp,gas | 2046.86 | J/mol×K | 1373.03 | Joback Calculated Property |
| Cp,gas | 2072.61 | J/mol×K | 1426.10 | Joback Calculated Property |
| η | [0.0000050; 0.0001798] | Pa×s | [557.48; 1107.69] |
|
| η | 0.0001798 | Pa×s | 557.48 | Joback Calculated Property |
| η | 0.0000649 | Pa×s | 649.18 | Joback Calculated Property |
| η | 0.0000301 | Pa×s | 740.88 | Joback Calculated Property |
| η | 0.0000166 | Pa×s | 832.59 | Joback Calculated Property |
| η | 0.0000103 | Pa×s | 924.29 | Joback Calculated Property |
| η | 0.0000069 | Pa×s | 1015.99 | Joback Calculated Property |
| η | 0.0000050 | Pa×s | 1107.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Octadecanoic acid octadeca-9,12-dienyl ester, Z.
Sources
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