- InChI
- InChI=1S/C15H18O5/c1-5-19-13(17)15(3,4)14(18)20-12-8-6-11(7-9-12)10(2)16/h6-9H,5H2,1-4H3
- InChI Key
- MFTKKTMKNWWZRH-UHFFFAOYSA-N
- Formula
- C15H18O5
- SMILES
-
CCOC(=O)C(C)(C)C(=O)Oc1ccc(C(C
)=O)cc1 - Molecular Weight1
- 278.30
- 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° | -415.72 | kJ/mol | Joback Calculated Property |
| ΔfH°gas | -738.80 | kJ/mol | Joback Calculated Property |
| ΔfusH° | 28.02 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 75.68 | kJ/mol | Joback Calculated Property |
| log10WS | -3.16 | Crippen Calculated Property | |
| logPoct/wat | 2.384 | Crippen Calculated Property | |
| McVol | 214.900 | ml/mol | McGowan Calculated Property |
| Pc | 2127.56 | kPa | Joback Calculated Property |
| Inp | [1984.00; 1984.00] |
|
|
| Inp | 1984.00 | NIST | |
| Inp | 1984.00 | NIST | |
| Tboil | 777.48 | K | Joback Calculated Property |
| Tc | 996.60 | K | Joback Calculated Property |
| Tfus | 494.42 | K | Joback Calculated Property |
| Vc | 0.810 | m3/kmol | Joback Calculated Property |
Temperature Dependent Properties
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [611.30; 676.42] | J/mol×K | [777.48; 996.60] |
|
| Cp,gas | 611.30 | J/mol×K | 777.48 | Joback Calculated Property |
| Cp,gas | 624.71 | J/mol×K | 814.00 | Joback Calculated Property |
| Cp,gas | 637.05 | J/mol×K | 850.52 | Joback Calculated Property |
| Cp,gas | 648.37 | J/mol×K | 887.04 | Joback Calculated Property |
| Cp,gas | 658.68 | J/mol×K | 923.56 | Joback Calculated Property |
| Cp,gas | 668.02 | J/mol×K | 960.08 | Joback Calculated Property |
| Cp,gas | 676.42 | J/mol×K | 996.60 | Joback Calculated Property |
| η | [0.0000843; 0.0007284] | Pa×s | [494.42; 777.48] |
|
| η | 0.0007284 | Pa×s | 494.42 | Joback Calculated Property |
| η | 0.0004348 | Pa×s | 541.60 | Joback Calculated Property |
| η | 0.0002820 | Pa×s | 588.77 | Joback Calculated Property |
| η | 0.0001950 | Pa×s | 635.95 | Joback Calculated Property |
| η | 0.0001419 | Pa×s | 683.13 | Joback Calculated Property |
| η | 0.0001075 | Pa×s | 730.30 | Joback Calculated Property |
| η | 0.0000843 | Pa×s | 777.48 | Joback Calculated Property |
Similar Compounds
Find more compounds similar to Dimethylmalonic acid, 4-acetylphenyl ethyl ester.
Sources
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