- InChI
- InChI=1S/C26H46O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21-26(27)28-23-22-25(4)20-18-19-24(2)3/h10-11,19,22H,5-9,12-18,20-21,23H2,1-4H3/b11-10-,25-22+
- InChI Key
- LSHLMRRKUOWTIW-PYHWRHASSA-N
- Formula
- C26H46O2
- SMILES
-
CCCCCCC=CCCCCCCCC(=O)OCC=C(C)C
CC=C(C)C - Molecular Weight1
- 390.64
- 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).
- 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° | 157.68 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -492.69 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 63.87 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 82.66 | kJ/mol | Joback Calculated Property |
| log10WS | -9.13 | Crippen Calculated Property | |
| logPoct/wat | 8.480 | Crippen Calculated Property | |
| McVol | 371.740 | ml/mol | McGowan Calculated Property |
| Pc | 815.39 | kPa | Joback Calculated Property |
| Inp | [2730.00; 2730.00] |
|
|
| Inp | 2730.00 | NIST | |
| Inp | 2730.00 | NIST | |
| Tboil | 882.81 | K | Joback Calculated Property |
| Tc | 1081.02 | K | Joback Calculated Property |
| Tfus | 411.78 | K | Joback Calculated Property |
| Vc | 1.458 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1205.79; 1318.15] | J/mol×K | [882.81; 1081.02] |
|
| Cp,gas | 1205.79 | J/mol×K | 882.81 | Joback Calculated Property |
| Cp,gas | 1226.82 | J/mol×K | 915.85 | Joback Calculated Property |
| Cp,gas | 1246.82 | J/mol×K | 948.88 | Joback Calculated Property |
| Cp,gas | 1265.87 | J/mol×K | 981.92 | Joback Calculated Property |
| Cp,gas | 1284.05 | J/mol×K | 1014.95 | Joback Calculated Property |
| Cp,gas | 1301.45 | J/mol×K | 1047.99 | Joback Calculated Property |
| Cp,gas | 1318.15 | J/mol×K | 1081.02 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Geranyl palmitoleate.
Sources
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