- InChI
- InChI=1S/C19H28O4/c1-6-13-22-17(20)19(7-2,8-3)18(21)23-16-12-10-9-11-15(16)14(4)5/h9-12,14H,6-8,13H2,1-5H3
- InChI Key
- PDVUHZLBUGHZST-UHFFFAOYSA-N
- Formula
- C19H28O4
- SMILES
-
CCCOC(=O)C(CC)(CC)C(=O)Oc1cccc
c1C(C)C - Molecular Weight1
- 320.42
- 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° | -255.56 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -714.06 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.25 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 77.45 | kJ/mol | Joback Calculated Property |
| log10WS | -4.94 | Crippen Calculated Property | |
| logPoct/wat | 4.475 | Crippen Calculated Property | |
| McVol | 269.690 | ml/mol | McGowan Calculated Property |
| Pc | 1471.36 | kPa | Joback Calculated Property |
| Inp | [1944.00; 1944.00] |
|
|
| Inp | 1944.00 | NIST | |
| Inp | 1944.00 | NIST | |
| Tboil | 814.69 | K | Joback Calculated Property |
| Tc | 1022.76 | K | Joback Calculated Property |
| Tfus | 474.57 | K | Joback Calculated Property |
| Vc | 1.022 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [820.88; 902.07] | J/mol×K | [814.69; 1022.76] |
|
| Cp,gas | 820.88 | J/mol×K | 814.69 | Joback Calculated Property |
| Cp,gas | 837.19 | J/mol×K | 849.37 | Joback Calculated Property |
| Cp,gas | 852.34 | J/mol×K | 884.05 | Joback Calculated Property |
| Cp,gas | 866.36 | J/mol×K | 918.73 | Joback Calculated Property |
| Cp,gas | 879.29 | J/mol×K | 953.41 | Joback Calculated Property |
| Cp,gas | 891.18 | J/mol×K | 988.09 | Joback Calculated Property |
| Cp,gas | 902.07 | J/mol×K | 1022.76 | Joback Calculated Property |
| η | [0.0000461; 0.0007029] | Pa×s | [474.57; 814.69] |
|
| η | 0.0007029 | Pa×s | 474.57 | Joback Calculated Property |
| η | 0.0003503 | Pa×s | 531.26 | Joback Calculated Property |
| η | 0.0001997 | Pa×s | 587.94 | Joback Calculated Property |
| η | 0.0001257 | Pa×s | 644.63 | Joback Calculated Property |
| η | 0.0000852 | Pa×s | 701.32 | Joback Calculated Property |
| η | 0.0000613 | Pa×s | 758.00 | Joback Calculated Property |
| η | 0.0000461 | Pa×s | 814.69 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 2-isopropylphenyl propyl ester.
Sources
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