Chemical Properties of Diethylmalonic acid, 3,4-difluorobenzyl isobutyl ester

Diethylmalonic acid, 3,4-difluorobenzyl isobutyl ester

InChI
InChI=1S/C18H24F2O4/c1-5-18(6-2,16(21)23-10-12(3)4)17(22)24-11-13-7-8-14(19)15(20)9-13/h7-9,12H,5-6,10-11H2,1-4H3
InChI Key
ZICCWDANXNQPTP-UHFFFAOYSA-N
Formula
C18H24F2O4
SMILES
CCC(CC)(C(=O)OCc1ccc(F)c(F)c1)C(=O)OCC(C)C
Molecular Weight1
342.38
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Physical Properties

Property Value Unit Source
ΔfusH° 39.60 kJ/mol Joback Calculated Property
logPoct/wat 4.014 Crippen Calculated Property
McVol 259.140 ml/mol McGowan Calculated Property
Inp [1922.00; 1922.00]   Show Hide
Inp 1922.00 NIST
Inp 1922.00 NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas [766.05; 842.53] J/mol×K [759.39; 953.07] Show Hide
Cp,gas 766.05 J/mol×K 759.39 Joback Calculated Property
Cp,gas 781.42 J/mol×K 791.67 Joback Calculated Property
Cp,gas 795.70 J/mol×K 823.95 Joback Calculated Property
Cp,gas 808.92 J/mol×K 856.23 Joback Calculated Property
Cp,gas 821.11 J/mol×K 888.51 Joback Calculated Property
Cp,gas 832.30 J/mol×K 920.79 Joback Calculated Property
Cp,gas 842.53 J/mol×K 953.07 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, 3,4-difluorobenzyl propyl ester. Diethylmalonic acid, pentyl 3,4-difluorobenzyl ester. Diethylmalonic acid, 3,4-difluorobenzyl hexyl ester. Diethylmalonic acid, 3,4-difluorobenzyl heptadecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl dodecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl heptyl ester. Diethylmalonic acid, 3,4-difluorobenzyl tridecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl nonyl ester. Diethylmalonic acid, 3,4-difluorobenzyl undecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl decyl ester. Diethylmalonic acid, 3,4-difluorobenzyl octadecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl hexadecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl pentadecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl octyl ester. Diethylmalonic acid, 3,4-difluorobenzyl ethyl ester.

Find more compounds similar to Diethylmalonic acid, 3,4-difluorobenzyl isobutyl ester.

Sources

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