- InChI
- InChI=1S/C21H20O6/c1-3-21(4-2,19(24)26-17-11-7-5-9-15(17)13-22)20(25)27-18-12-8-6-10-16(18)14-23/h5-14H,3-4H2,1-2H3
- InChI Key
- RRAMFOAYFMRLNN-UHFFFAOYSA-N
- Formula
- C21H20O6
- SMILES
-
CCC(CC)(C(=O)Oc1ccccc1C=O)C(=O
)Oc1ccccc1C=O - Molecular Weight1
- 368.38
- 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° | -332.54 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -696.16 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 40.19 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 98.67 | kJ/mol | Joback Calculated Property |
| log10WS | -5.25 | Crippen Calculated Property | |
| logPoct/wat | 3.629 | Crippen Calculated Property | |
| McVol | 277.250 | ml/mol | McGowan Calculated Property |
| Pc | 1821.61 | kPa | Joback Calculated Property |
| Inp | 2800.00 | NIST | |
| Tboil | 989.87 | K | Joback Calculated Property |
| Tc | 1227.39 | K | Joback Calculated Property |
| Tfus | 635.05 | K | Joback Calculated Property |
| Vc | 1.067 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [854.96; 898.75] | J/mol×K | [989.87; 1227.39] | 
|
| Cp,gas | 854.96 | J/mol×K | 989.87 | Joback Calculated Property |
| Cp,gas | 865.09 | J/mol×K | 1029.46 | Joback Calculated Property |
| Cp,gas | 873.99 | J/mol×K | 1069.04 | Joback Calculated Property |
| Cp,gas | 881.75 | J/mol×K | 1108.63 | Joback Calculated Property |
| Cp,gas | 888.41 | J/mol×K | 1148.22 | Joback Calculated Property |
| Cp,gas | 894.06 | J/mol×K | 1187.80 | Joback Calculated Property |
| Cp,gas | 898.75 | J/mol×K | 1227.39 | Joback Calculated Property |
| η | [0.0000438; 0.0003367] | Pa×s | [635.05; 989.87] |
|
| η | 0.0003367 | Pa×s | 635.05 | Joback Calculated Property |
| η | 0.0002074 | Pa×s | 694.19 | Joback Calculated Property |
| η | 0.0001378 | Pa×s | 753.32 | Joback Calculated Property |
| η | 0.0000972 | Pa×s | 812.46 | Joback Calculated Property |
| η | 0.0000719 | Pa×s | 871.60 | Joback Calculated Property |
| η | 0.0000552 | Pa×s | 930.73 | Joback Calculated Property |
| η | 0.0000438 | Pa×s | 989.87 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, di(2-formylphenyl) ester.
Sources
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