- InChI
- InChI=1S/C19H26O5/c1-5-8-13-23-17(21)19(6-2,7-3)18(22)24-16-11-9-15(10-12-16)14(4)20/h9-12H,5-8,13H2,1-4H3
- InChI Key
- KOKNKQBDZDTXJR-UHFFFAOYSA-N
- Formula
- C19H26O5
- SMILES
-
CCCCOC(=O)C(CC)(CC)C(=O)Oc1ccc
(C(C)=O)cc1 - Molecular Weight1
- 334.41
- 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° | -382.04 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -821.36 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 38.38 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 84.59 | kJ/mol | Joback Calculated Property |
| log10WS | -4.83 | Crippen Calculated Property | |
| logPoct/wat | 3.944 | Crippen Calculated Property | |
| McVol | 271.260 | ml/mol | McGowan Calculated Property |
| Pc | 1535.46 | kPa | Joback Calculated Property |
| Inp | 2327.00 | NIST | |
| Tboil | 869.00 | K | Joback Calculated Property |
| Tc | 1081.69 | K | Joback Calculated Property |
| Tfus | 539.50 | K | Joback Calculated Property |
| Vc | 1.034 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [836.40; 905.54] | J/mol×K | [869.00; 1081.69] | 
|
| Cp,gas | 836.40 | J/mol×K | 869.00 | Joback Calculated Property |
| Cp,gas | 850.67 | J/mol×K | 904.45 | Joback Calculated Property |
| Cp,gas | 863.79 | J/mol×K | 939.90 | Joback Calculated Property |
| Cp,gas | 875.80 | J/mol×K | 975.34 | Joback Calculated Property |
| Cp,gas | 886.73 | J/mol×K | 1010.79 | Joback Calculated Property |
| Cp,gas | 896.63 | J/mol×K | 1046.24 | Joback Calculated Property |
| Cp,gas | 905.54 | J/mol×K | 1081.69 | Joback Calculated Property |
| η | [0.0000474; 0.0004839] | Pa×s | [539.50; 869.00] |
|
| η | 0.0004839 | Pa×s | 539.50 | Joback Calculated Property |
| η | 0.0002747 | Pa×s | 594.42 | Joback Calculated Property |
| η | 0.0001717 | Pa×s | 649.33 | Joback Calculated Property |
| η | 0.0001154 | Pa×s | 704.25 | Joback Calculated Property |
| η | 0.0000822 | Pa×s | 759.17 | Joback Calculated Property |
| η | 0.0000613 | Pa×s | 814.08 | Joback Calculated Property |
| η | 0.0000474 | Pa×s | 869.00 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 4-acetylphenyl butyl ester.
Sources
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