- InChI
- InChI=1S/C21H24O6/c1-5-21(6-2,19(22)26-17-11-7-9-15(13-17)24-3)20(23)27-18-12-8-10-16(14-18)25-4/h7-14H,5-6H2,1-4H3
- InChI Key
- JYGDUBSIFOBSOT-UHFFFAOYSA-N
- Formula
- C21H24O6
- SMILES
-
CCC(CC)(C(=O)Oc1cccc(OC)c1)C(=
O)Oc1cccc(OC)c1 - Molecular Weight1
- 372.41
- 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° | -343.50 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -789.44 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 37.99 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 90.05 | kJ/mol | Joback Calculated Property |
| log10WS | -5.00 | Crippen Calculated Property | |
| logPoct/wat | 4.021 | Crippen Calculated Property | |
| McVol | 285.850 | ml/mol | McGowan Calculated Property |
| Pc | 1568.47 | kPa | Joback Calculated Property |
| Inp | [2668.00; 2668.00] |
|
|
| Inp | 2668.00 | NIST | |
| Inp | 2668.00 | NIST | |
| Tboil | 937.39 | K | Joback Calculated Property |
| Tc | 1166.72 | K | Joback Calculated Property |
| Tfus | 595.51 | K | Joback Calculated Property |
| Vc | 1.069 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [893.05; 947.19] | J/mol×K | [937.39; 1166.72] |
|
| Cp,gas | 893.05 | J/mol×K | 937.39 | Joback Calculated Property |
| Cp,gas | 905.78 | J/mol×K | 975.61 | Joback Calculated Property |
| Cp,gas | 917.00 | J/mol×K | 1013.83 | Joback Calculated Property |
| Cp,gas | 926.72 | J/mol×K | 1052.05 | Joback Calculated Property |
| Cp,gas | 934.98 | J/mol×K | 1090.27 | Joback Calculated Property |
| Cp,gas | 941.79 | J/mol×K | 1128.50 | Joback Calculated Property |
| Cp,gas | 947.19 | J/mol×K | 1166.72 | Joback Calculated Property |
| η | [0.0000213; 0.0001790] | Pa×s | [595.51; 937.39] |
|
| η | 0.0001790 | Pa×s | 595.51 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 652.49 | Joback Calculated Property |
| η | 0.0000701 | Pa×s | 709.47 | Joback Calculated Property |
| η | 0.0000487 | Pa×s | 766.45 | Joback Calculated Property |
| η | 0.0000356 | Pa×s | 823.43 | Joback Calculated Property |
| η | 0.0000271 | Pa×s | 880.41 | Joback Calculated Property |
| η | 0.0000213 | Pa×s | 937.39 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, di(3-methoxyphenyl) ester.
Sources
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