- InChI
- InChI=1S/C22H18O4/c1-16-6-2-5-9-20(16)26-22(24)13-12-21(23)25-15-17-10-11-18-7-3-4-8-19(18)14-17/h2-14H,15H2,1H3/b13-12+
- InChI Key
- SQDLOEHYLAICFF-OUKQBFOZSA-N
- Formula
- C22H18O4
- SMILES
-
Cc1ccccc1OC(=O)C=CC(=O)OCc1ccc
2ccccc2c1 - Molecular Weight1
- 346.38
- 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° | 58.95 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -228.60 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 42.84 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.35 | kJ/mol | Joback Calculated Property |
| log10WS | -6.15 | Crippen Calculated Property | |
| logPoct/wat | 4.353 | Crippen Calculated Property | |
| McVol | 264.440 | ml/mol | McGowan Calculated Property |
| Pc | 1875.65 | kPa | Joback Calculated Property |
| Inp | [2971.00; 2971.00] |
|
|
| Inp | 2971.00 | NIST | |
| Inp | 2971.00 | NIST | |
| Tboil | 941.80 | K | Joback Calculated Property |
| Tc | 1186.77 | K | Joback Calculated Property |
| Tfus | 587.52 | K | Joback Calculated Property |
| Vc | 1.002 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [787.27; 848.92] | J/mol×K | [941.80; 1186.77] |
|
| Cp,gas | 787.27 | J/mol×K | 941.80 | Joback Calculated Property |
| Cp,gas | 799.85 | J/mol×K | 982.63 | Joback Calculated Property |
| Cp,gas | 811.37 | J/mol×K | 1023.46 | Joback Calculated Property |
| Cp,gas | 821.93 | J/mol×K | 1064.29 | Joback Calculated Property |
| Cp,gas | 831.64 | J/mol×K | 1105.12 | Joback Calculated Property |
| Cp,gas | 840.60 | J/mol×K | 1145.94 | Joback Calculated Property |
| Cp,gas | 848.92 | J/mol×K | 1186.77 | Joback Calculated Property |
| η | [0.0000780; 0.0004573] | Pa×s | [587.52; 941.80] |
|
| η | 0.0004573 | Pa×s | 587.52 | Joback Calculated Property |
| η | 0.0002977 | Pa×s | 646.57 | Joback Calculated Property |
| η | 0.0002082 | Pa×s | 705.61 | Joback Calculated Property |
| η | 0.0001539 | Pa×s | 764.66 | Joback Calculated Property |
| η | 0.0001188 | Pa×s | 823.71 | Joback Calculated Property |
| η | 0.0000950 | Pa×s | 882.75 | Joback Calculated Property |
| η | 0.0000780 | Pa×s | 941.80 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Fumaric acid, 2-methylphenyl naphth-2-ylmethyl ester.
Sources
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