Chemical Properties of Diethylmalonic acid, propyl 4-trifluoromethylbenzyl ester

Diethylmalonic acid, propyl 4-trifluoromethylbenzyl ester

InChI
InChI=1S/C18H23F3O4/c1-4-11-24-15(22)17(5-2,6-3)16(23)25-12-13-7-9-14(10-8-13)18(19,20)21/h7-10H,4-6,11-12H2,1-3H3
InChI Key
GLBRVHXXQXKLQH-UHFFFAOYSA-N
Formula
C18H23F3O4
SMILES
CCCOC(=O)C(CC)(CC)C(=O)OCc1ccc(C(F)(F)F)cc1
Molecular Weight1
360.37
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Physical Properties

Property Value Unit Source
ΔfusH° 39.18 kJ/mol Joback Calculated Property
logPoct/wat 4.508 Crippen Calculated Property
McVol 260.910 ml/mol McGowan Calculated Property
Inp 1862.00 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 [775.84; 850.69] J/mol×K [750.89; 942.37] Show Hide
Cp,gas 775.84 J/mol×K 750.89 Joback Calculated Property
Cp,gas 790.88 J/mol×K 782.80 Joback Calculated Property
Cp,gas 804.83 J/mol×K 814.72 Joback Calculated Property
Cp,gas 817.74 J/mol×K 846.63 Joback Calculated Property
Cp,gas 829.65 J/mol×K 878.54 Joback Calculated Property
Cp,gas 840.62 J/mol×K 910.45 Joback Calculated Property
Cp,gas 850.69 J/mol×K 942.37 Joback Calculated Property

Similar Compounds

Diethylmalonic acid, butyl 4-trifluoromethylbenzyl ester. Diethylmalonic acid, isobutyl 4-trifluoromethylbenzyl ester. Diethylmalonic acid, pentyl 4-trifluoromethylbenzyl ester. Diethylmalonic acid, ethyl 4-trifluoromethylbenzyl ester. Diethylmalonic acid, hexyl 4-trifluoromethylbenzyl ester. Diethylmalonic acid, octyl 4-trifluoromethylbenzyl ester. Diethylmalonic acid, heptyl 4-trifluoromethylbenzyl ester. Diethylmalonic acid, 4-chlorobenzyl propyl ester. Diethylmalonic acid, 4-bromobenzyl propyl ester. Diethylmalonic acid, di(4-trifluoromethylbenzyl) ester. Diethylmalonic acid, 3-methylbenzyl propyl ester. Diethylmalonic acid, butyl 4-chlorobenzyl ester. Diethylmalonic acid, 3-chlorobenzyl propyl ester. Diethylmalonic acid, 4-bromobenzyl butyl ester. Diethylmalonic acid, 4-bromobenzyl isobutyl ester.

Find more compounds similar to Diethylmalonic acid, propyl 4-trifluoromethylbenzyl ester.

Sources

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