Chemical Properties of Diethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester

Diethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester

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InChI
InChI=1S/C17H22ClFO4/c1-5-17(6-2,15(20)22-10-11(3)4)16(21)23-14-12(18)8-7-9-13(14)19/h7-9,11H,5-6,10H2,1-4H3
InChI Key
CVSOITUDTHCMNK-UHFFFAOYSA-N
Formula
C17H22ClFO4
SMILES
CCC(CC)(C(=O)OCC(C)C)C(=O)Oc1c(F)cccc1Cl
Molecular Weight1
344.81
Sources

Physical Properties

Property Value Unit Source
Δf -488.77 kJ/mol Joback Calculated Property
Δfgas -896.10 kJ/mol Joback Calculated Property
Δfus 34.96 kJ/mol Joback Calculated Property
Δvap 77.23 kJ/mol Joback Calculated Property
logPoct/wat 4.39 Crippen Calculated Property
Pc 1584.75 kPa Joback Calculated Property
Tboil 810.61 K Joback Calculated Property
Tc 1019.61 K Joback Calculated Property
Tfus 495.06 K Joback Calculated Property
Vc 0.98 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 740.00 J/mol×K 810.61 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-F 1
=CH- (ring) 3
=C< (ring) 3
-CH2- 3
-Cl 1
>C< 1
-CH3 4
>C=O (nonring) 2

Similar Compounds

Diethylmalonic acid, butyl 2-chloro-6-fluorophenyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl hexyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl pentadecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl tetradecyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl decyl ester. Diethylmalonic acid, 2-chloro-6-fluorophenyl tridecyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl hexyl ester. Dimethylmalonic acid, butyl 2-chloro-6-fluorophenyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl heptyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl pentadecyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl undecyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl propyl ester. Dimethylmalonic acid, 2-chloro-6-fluorophenyl ethyl ester. Diethylmalonic acid, 2-chlorophenyl isobutyl ester. Diethylmalonic acid, 2-chlorophenyl pentyl ester.

Find more compounds similar to Diethylmalonic acid, 2-chloro-6-fluorophenyl isobutyl ester.

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