- InChI
- InChI=1S/C34H60O2/c1-3-5-7-9-11-13-15-17-19-20-22-24-26-28-30-32-34(35)36-33-31-29-27-25-23-21-18-16-14-12-10-8-6-4-2/h5,7,11,13,17-19,21H,3-4,6,8-10,12,14-16,20,22-33H2,1-2H3/b7-5-,13-11-,19-17-,21-18+
- InChI Key
- ZZMQTBJTUVDBDO-PLNKFGNASA-N
- Formula
- C34H60O2
- SMILES
-
CCC=CCC=CCC=CCCCCCCCC(=O)OCCCC
CCC=CCCCCCCCC - Molecular Weight1
- 500.84
- 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° | 322.36 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -521.01 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 87.41 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 100.27 | kJ/mol | Joback Calculated Property |
| log10WS | -12.33 | Crippen Calculated Property | |
| logPoct/wat | 11.376 | Crippen Calculated Property | |
| McVol | 480.160 | ml/mol | McGowan Calculated Property |
| Pc | 559.41 | kPa | Joback Calculated Property |
| Inp | [3504.89; 3504.89] |
|
|
| Inp | 3504.89 | NIST | |
| Inp | 3504.89 | NIST | |
| Tboil | 1070.25 | K | Joback Calculated Property |
| Tc | 1341.75 | K | Joback Calculated Property |
| Tfus | 524.78 | K | Joback Calculated Property |
| Vc | 1.883 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1706.86; 1869.21] | J/mol×K | [1070.25; 1341.75] |
|
| Cp,gas | 1706.86 | J/mol×K | 1070.25 | Joback Calculated Property |
| Cp,gas | 1735.97 | J/mol×K | 1115.50 | Joback Calculated Property |
| Cp,gas | 1763.87 | J/mol×K | 1160.75 | Joback Calculated Property |
| Cp,gas | 1790.85 | J/mol×K | 1206.00 | Joback Calculated Property |
| Cp,gas | 1817.21 | J/mol×K | 1251.25 | Joback Calculated Property |
| Cp,gas | 1843.24 | J/mol×K | 1296.50 | Joback Calculated Property |
| Cp,gas | 1869.21 | J/mol×K | 1341.75 | Joback Calculated Property |
| η | [0.0000054; 0.0002118] | Pa×s | [524.78; 1070.25] |
|
| η | 0.0002118 | Pa×s | 524.78 | Joback Calculated Property |
| η | 0.0000730 | Pa×s | 615.69 | Joback Calculated Property |
| η | 0.0000331 | Pa×s | 706.60 | Joback Calculated Property |
| η | 0.0000180 | Pa×s | 797.51 | Joback Calculated Property |
| η | 0.0000111 | Pa×s | 888.43 | Joback Calculated Property |
| η | 0.0000074 | Pa×s | 979.34 | Joback Calculated Property |
| η | 0.0000054 | Pa×s | 1070.25 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Octadeca-9,12,15-trienoic acid hexadec-7-enyl ester, Z,Z,Z,Z.
Sources
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