- InChI
- InChI=1S/C18H16O4/c1-2-21-17(19)12-13-18(20)22-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-13H,2H2,1H3/b13-12+
- InChI Key
- NQVLMHVHROWIGB-OUKQBFOZSA-N
- Formula
- C18H16O4
- SMILES
-
CCOC(=O)C=CC(=O)Oc1ccc(-c2cccc
c2)cc1 - Molecular Weight1
- 296.32
- 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° | -71.75 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -325.64 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 35.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 79.15 | kJ/mol | Joback Calculated Property |
| log10WS | -4.78 | Crippen Calculated Property | |
| logPoct/wat | 3.378 | Crippen Calculated Property | |
| McVol | 227.540 | ml/mol | McGowan Calculated Property |
| Pc | 2153.30 | kPa | Joback Calculated Property |
| Inp | 2501.00 | NIST | |
| Tboil | 826.32 | K | Joback Calculated Property |
| Tc | 1062.33 | K | Joback Calculated Property |
| Tfus | 497.22 | K | Joback Calculated Property |
| Vc | 0.856 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [641.64; 705.44] | J/mol×K | [826.32; 1062.33] | 
|
| Cp,gas | 641.64 | J/mol×K | 826.32 | Joback Calculated Property |
| Cp,gas | 655.10 | J/mol×K | 865.65 | Joback Calculated Property |
| Cp,gas | 667.36 | J/mol×K | 904.99 | Joback Calculated Property |
| Cp,gas | 678.47 | J/mol×K | 944.32 | Joback Calculated Property |
| Cp,gas | 688.48 | J/mol×K | 983.66 | Joback Calculated Property |
| Cp,gas | 697.45 | J/mol×K | 1022.99 | Joback Calculated Property |
| Cp,gas | 705.44 | J/mol×K | 1062.33 | Joback Calculated Property |
| η | [0.0000639; 0.0005707] | Pa×s | [497.22; 826.32] |
|
| η | 0.0005707 | Pa×s | 497.22 | Joback Calculated Property |
| η | 0.0003305 | Pa×s | 552.07 | Joback Calculated Property |
| η | 0.0002113 | Pa×s | 606.92 | Joback Calculated Property |
| η | 0.0001455 | Pa×s | 661.77 | Joback Calculated Property |
| η | 0.0001060 | Pa×s | 716.62 | Joback Calculated Property |
| η | 0.0000808 | Pa×s | 771.47 | Joback Calculated Property |
| η | 0.0000639 | Pa×s | 826.32 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, ethyl 4-phenylphenyl ester.
Sources
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