- InChI
- InChI=1S/C17H22O5/c1-5-17(6-2,15(19)21-7-3)16(20)22-14-10-8-13(9-11-14)12(4)18/h8-11H,5-7H2,1-4H3
- InChI Key
- GRNIXVZNIVYKBO-UHFFFAOYSA-N
- Formula
- C17H22O5
- SMILES
-
CCOC(=O)C(CC)(CC)C(=O)Oc1ccc(C
(C)=O)cc1 - Molecular Weight1
- 306.35
- 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° | -398.88 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -780.08 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 33.20 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 80.14 | kJ/mol | Joback Calculated Property |
| log10WS | -4.00 | Crippen Calculated Property | |
| logPoct/wat | 3.164 | Crippen Calculated Property | |
| McVol | 243.080 | ml/mol | McGowan Calculated Property |
| Pc | 1795.46 | kPa | Joback Calculated Property |
| Inp | 2153.00 | NIST | |
| Tboil | 823.24 | K | Joback Calculated Property |
| Tc | 1037.89 | K | Joback Calculated Property |
| Tfus | 516.96 | K | Joback Calculated Property |
| Vc | 0.922 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [722.07; 789.60] | J/mol×K | [823.24; 1037.89] | 
|
| Cp,gas | 722.07 | J/mol×K | 823.24 | Joback Calculated Property |
| Cp,gas | 735.97 | J/mol×K | 859.02 | Joback Calculated Property |
| Cp,gas | 748.77 | J/mol×K | 894.79 | Joback Calculated Property |
| Cp,gas | 760.50 | J/mol×K | 930.57 | Joback Calculated Property |
| Cp,gas | 771.19 | J/mol×K | 966.34 | Joback Calculated Property |
| Cp,gas | 780.88 | J/mol×K | 1002.12 | Joback Calculated Property |
| Cp,gas | 789.60 | J/mol×K | 1037.89 | Joback Calculated Property |
| η | [0.0000636; 0.0005988] | Pa×s | [516.96; 823.24] |
|
| η | 0.0005988 | Pa×s | 516.96 | Joback Calculated Property |
| η | 0.0003483 | Pa×s | 568.01 | Joback Calculated Property |
| η | 0.0002216 | Pa×s | 619.05 | Joback Calculated Property |
| η | 0.0001510 | Pa×s | 670.10 | Joback Calculated Property |
| η | 0.0001086 | Pa×s | 721.15 | Joback Calculated Property |
| η | 0.0000816 | Pa×s | 772.19 | Joback Calculated Property |
| η | 0.0000636 | Pa×s | 823.24 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Diethylmalonic acid, 4-acetylphenyl ethyl ester.
Sources
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