- InChI
- InChI=1S/C22H18O5/c1-25-19-8-4-5-9-20(19)27-22(24)13-12-21(23)26-15-16-10-11-17-6-2-3-7-18(17)14-16/h2-14H,15H2,1H3/b13-12+
- InChI Key
- IKHZOAPDBMCNCD-OUKQBFOZSA-N
- Formula
- C22H18O5
- SMILES
-
COc1ccccc1OC(=O)C=CC(=O)OCc1cc
c2ccccc2c1 - Molecular Weight1
- 362.38
- 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° | -46.05 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -360.82 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 44.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 92.76 | kJ/mol | Joback Calculated Property |
| log10WS | -5.79 | Crippen Calculated Property | |
| logPoct/wat | 4.053 | Crippen Calculated Property | |
| McVol | 270.310 | ml/mol | McGowan Calculated Property |
| Pc | 1848.33 | kPa | Joback Calculated Property |
| Inp | [3077.00; 3077.00] |
|
|
| Inp | 3077.00 | NIST | |
| Inp | 3077.00 | NIST | |
| Tboil | 964.22 | K | Joback Calculated Property |
| Tc | 1207.66 | K | Joback Calculated Property |
| Tfus | 609.75 | K | Joback Calculated Property |
| Vc | 1.020 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [812.95; 867.50] | J/mol×K | [964.22; 1207.66] |
|
| Cp,gas | 812.95 | J/mol×K | 964.22 | Joback Calculated Property |
| Cp,gas | 824.70 | J/mol×K | 1004.79 | Joback Calculated Property |
| Cp,gas | 835.28 | J/mol×K | 1045.37 | Joback Calculated Property |
| Cp,gas | 844.77 | J/mol×K | 1085.94 | Joback Calculated Property |
| Cp,gas | 853.25 | J/mol×K | 1126.51 | Joback Calculated Property |
| Cp,gas | 860.80 | J/mol×K | 1167.09 | Joback Calculated Property |
| Cp,gas | 867.50 | J/mol×K | 1207.66 | Joback Calculated Property |
| η | [0.0000588; 0.0003347] | Pa×s | [609.75; 964.22] |
|
| η | 0.0003347 | Pa×s | 609.75 | Joback Calculated Property |
| η | 0.0002204 | Pa×s | 668.83 | Joback Calculated Property |
| η | 0.0001554 | Pa×s | 727.91 | Joback Calculated Property |
| η | 0.0001154 | Pa×s | 786.99 | Joback Calculated Property |
| η | 0.0000893 | Pa×s | 846.06 | Joback Calculated Property |
| η | 0.0000715 | Pa×s | 905.14 | Joback Calculated Property |
| η | 0.0000588 | Pa×s | 964.22 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2-methoxyphenyl naphth-2-ylmethyl ester.
Sources
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