Chemical Properties of Ethyl trimethylacetopyruvate

Ethyl trimethylacetopyruvate

InChI
InChI=1S/C10H16O4/c1-5-14-9(13)7(11)6-8(12)10(2,3)4/h5-6H2,1-4H3
InChI Key
NIMKIMUBJFWPTD-UHFFFAOYSA-N
Formula
C10H16O4
SMILES
CCOC(=O)C(=O)CC(=O)C(C)(C)C
Molecular Weight1
200.23
Other Names
  • ethyl 5,5-dimethyl-2,4-dioxohexanoate
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Physical Properties

Property Value Unit Source
ΔfH°gas -782.01 kJ/mol Relay (1.0) Calculated Property
ΔfusH° 21.81 kJ/mol Joback Calculated Property
ΔvapH° 65.96 kJ/mol Relay (1.0) Calculated Property
IE 9.03 eV Relay (1.0) Calculated Property
log10WS -1.89 Relay (1.0) Calculated Property
logPoct/wat 1.124 Crippen Calculated Property
McVol 162.340 ml/mol McGowan Calculated Property
Pc 2431.44 kPa Joback Calculated Property
Tboil 502.50 K Relay (1.0) Calculated Property
Tc 692.78 K Relay (1.0) Calculated Property
Tfus 304.61 K Relay (1.0) Calculated Property

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property Value Unit Temperature (K) Source
Cp,gas [234.35; 522.85] J/mol×K [273.00; 1000.00] Joback Predicted correlation Show Hide
EquationY = A + B·T + C·T² + D·T³ + E·T⁴
Y is Cp,gas in J/mol×K, T in K
Coefficient A9.45200e+00
Coefficient B9.68880e-01
Coefficient C-5.60000e-04
Coefficient D1.04520e-07
Coefficient E0.00000e+00
Temperature range, min.273.00
Temperature range, max.1000.00
Cp,gas 234.35 J/mol×K 273.00 Calculated Property
Cp,gas 286.76 J/mol×K 353.78 Calculated Property
Cp,gas 333.31 J/mol×K 434.56 Calculated Property
Cp,gas 374.33 J/mol×K 515.33 Calculated Property
Cp,gas 410.16 J/mol×K 596.11 Calculated Property
Cp,gas 441.11 J/mol×K 676.89 Calculated Property
Cp,gas 467.53 J/mol×K 757.67 Calculated Property
Cp,gas 489.74 J/mol×K 838.44 Calculated Property
Cp,gas 508.07 J/mol×K 919.22 Calculated Property
Cp,gas 522.85 J/mol×K 1000.00 Calculated Property
Property Value Unit Temperature (K) Source
η [0.0033680; 0.0002669] Pa×s [347.07; 551.35] Joback Predicted correlation Show Hide
EquationY = exp(A + B/T + C·ln(T) + D·T^E)
Y is η in Pa×s, T in K
Coefficient A-1.25355e+01
Coefficient B2.37468e+03
Coefficient C0.00000e+00
Coefficient D0.00000e+00
Coefficient E0.00000e+00
CommentLiquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.347.07
Temperature range, max.551.35
η 0.0033680 Pa×s 347.07 Calculated Property
η 0.0022129 Pa×s 369.77 Calculated Property
η 0.0015264 Pa×s 392.47 Calculated Property
η 0.0010965 Pa×s 415.16 Calculated Property
η 0.0008151 Pa×s 437.86 Calculated Property
η 0.0006239 Pa×s 460.56 Calculated Property
η 0.0004897 Pa×s 483.26 Calculated Property
η 0.0003929 Pa×s 505.96 Calculated Property
η 0.0003212 Pa×s 528.66 Calculated Property
η 0.0002669 Pa×s 551.35 Calculated Property

Similar Compounds

Ethyl 2,4-dioxovalerate. Cyclohexane-1,3-dione, 5,5-dimethyl-2-(3'-carbethoxypropyl)-. 4-Oxoheptanedioic acid, diethyl ester. 6-Methyl - 2,4-dioxo-5- heptenoic acid, ethyl ester. Cyclohexanepropionic acid, 4-oxo-, ethyl ester. Pentanoic acid, 4-methyl-3-oxo-, ethyl ester. 2,2,4-Trimethyl-3-oxovaleric acid, ethyl ester. Octanoic acid, 4-methyl-, ethyl ester. Ethyladamantane-1-carboxylate. Hexanoic acid, 4-methyl-, ethyl ester. Cyclohexanecarboxylic acid, 2-oxo-, ethyl ester. Pentanoic acid, 4,4-dimethyl-3-oxo-, methyl ester. Heptanoic acid, 4-methyl-, ethyl ester. NONANOIC ACID, 5-METHYL-, ETHYL ESTER. Pentanoic acid, 4-oxo-, ethyl ester.

Find more compounds similar to Ethyl trimethylacetopyruvate.

Sources

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