- InChI
- InChI=1S/C25H44O4/c1-5-6-13-20-28-24(26)17-11-9-7-8-10-12-18-25(27)29-21-19-23(4)16-14-15-22(2)3/h15,19H,5-14,16-18,20-21H2,1-4H3/b23-19+
- InChI Key
- UVEHGSUFXDGKEJ-FCDQGJHFSA-N
- Formula
- C25H44O4
- SMILES
-
CCCCCOC(=O)CCCCCCCCC(=O)OCC=C(
C)CCC=C(C)C - Molecular Weight1
- 408.61
- 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° | -164.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -834.07 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 63.86 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 89.63 | kJ/mol | Joback Calculated Property |
| log10WS | -7.72 | Crippen Calculated Property | |
| logPoct/wat | 7.076 | Crippen Calculated Property | |
| McVol | 369.390 | ml/mol | McGowan Calculated Property |
| Pc | 858.98 | kPa | Joback Calculated Property |
| Inp | 2849.00 | NIST | |
| Tboil | 932.06 | K | Joback Calculated Property |
| Tc | 1141.47 | K | Joback Calculated Property |
| Tfus | 477.75 | K | Joback Calculated Property |
| Vc | 1.446 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [1225.54; 1325.65] | J/mol×K | [932.06; 1141.47] | 
|
| Cp,gas | 1225.54 | J/mol×K | 932.06 | Joback Calculated Property |
| Cp,gas | 1245.08 | J/mol×K | 966.96 | Joback Calculated Property |
| Cp,gas | 1263.38 | J/mol×K | 1001.86 | Joback Calculated Property |
| Cp,gas | 1280.53 | J/mol×K | 1036.76 | Joback Calculated Property |
| Cp,gas | 1296.58 | J/mol×K | 1071.67 | Joback Calculated Property |
| Cp,gas | 1311.60 | J/mol×K | 1106.57 | Joback Calculated Property |
| Cp,gas | 1325.65 | J/mol×K | 1141.47 | Joback Calculated Property |
Similar Compounds
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Sources
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