- InChI
- InChI=1S/C23H26O4/c1-2-3-4-5-9-18-26-22(24)16-17-23(25)27-21-14-12-20(13-15-21)19-10-7-6-8-11-19/h6-8,10-17H,2-5,9,18H2,1H3/b17-16+
- InChI Key
- NOFHNUOQLIPSML-WUKNDPDISA-N
- Formula
- C23H26O4
- SMILES
-
CCCCCCCOC(=O)C=CC(=O)Oc1ccc(-c
2ccccc2)cc1 - Molecular Weight1
- 366.45
- 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° | -29.65 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -428.84 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 48.79 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.28 | kJ/mol | Joback Calculated Property |
| log10WS | -6.87 | Crippen Calculated Property | |
| logPoct/wat | 5.329 | Crippen Calculated Property | |
| McVol | 297.990 | ml/mol | McGowan Calculated Property |
| Pc | 1440.25 | kPa | Joback Calculated Property |
| Inp | [3073.00; 3073.00] |
|
|
| Inp | 3073.00 | NIST | |
| Inp | 3073.00 | NIST | |
| Tboil | 940.72 | K | Joback Calculated Property |
| Tc | 1166.83 | K | Joback Calculated Property |
| Tfus | 553.57 | K | Joback Calculated Property |
| Vc | 1.135 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [928.62; 996.18] | J/mol×K | [940.72; 1166.83] |
|
| Cp,gas | 928.62 | J/mol×K | 940.72 | Joback Calculated Property |
| Cp,gas | 942.75 | J/mol×K | 978.41 | Joback Calculated Property |
| Cp,gas | 955.64 | J/mol×K | 1016.09 | Joback Calculated Property |
| Cp,gas | 967.37 | J/mol×K | 1053.78 | Joback Calculated Property |
| Cp,gas | 977.99 | J/mol×K | 1091.46 | Joback Calculated Property |
| Cp,gas | 987.57 | J/mol×K | 1129.15 | Joback Calculated Property |
| Cp,gas | 996.18 | J/mol×K | 1166.83 | Joback Calculated Property |
| η | [0.0000322; 0.0003490] | Pa×s | [553.57; 940.72] |
|
| η | 0.0003490 | Pa×s | 553.57 | Joback Calculated Property |
| η | 0.0001907 | Pa×s | 618.09 | Joback Calculated Property |
| η | 0.0001168 | Pa×s | 682.62 | Joback Calculated Property |
| η | 0.0000779 | Pa×s | 747.14 | Joback Calculated Property |
| η | 0.0000554 | Pa×s | 811.67 | Joback Calculated Property |
| η | 0.0000414 | Pa×s | 876.20 | Joback Calculated Property |
| η | 0.0000322 | Pa×s | 940.72 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, heptyl 4-phenylphenyl ester.
Sources
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