Chemical Properties of Diethylmalonic acid, di(4-fluoro-2-methoxyphenyl) ester

Diethylmalonic acid, di(4-fluoro-2-methoxyphenyl) ester

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InChI
InChI=1S/C21H22F2O6/c1-5-21(6-2,19(24)28-15-9-7-13(22)11-17(15)26-3)20(25)29-16-10-8-14(23)12-18(16)27-4/h7-12H,5-6H2,1-4H3
InChI Key
BQNRXXKLOKNMNX-UHFFFAOYSA-N
Formula
C21H22F2O6
SMILES
CCC(CC)(C(=O)Oc1ccc(F)cc1OC)C(=O)Oc1ccc(F)cc1OC
Molecular Weight1
408.39
Sources

Physical Properties

Property Value Unit Source
Δf -752.38 kJ/mol Joback Calculated Property
Δfgas -1204.60 kJ/mol Joback Calculated Property
Δfus 43.37 kJ/mol Joback Calculated Property
Δvap 89.74 kJ/mol Joback Calculated Property
logPoct/wat 4.30 Crippen Calculated Property
Pc 1429.38 kPa Joback Calculated Property
Tboil 945.89 K Joback Calculated Property
Tc 1167.46 K Joback Calculated Property
Tfus 621.73 K Joback Calculated Property
Vc 1.10 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 904.50 J/mol×K 945.89 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 4
-F 2
=CH- (ring) 6
=C< (ring) 6
-CH2- 2
>C< 1
-CH3 4
>C=O (nonring) 2

Similar Compounds

Diethylmalonic acid, butyl 4-fluoro-2-methoxyphenyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl propyl ester. Diethylmalonic acid, di(2-isopropoxyphenyl) ester. Diethylmalonic acid, isobutyl 4-fluoro-2-methoxyphenyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl pentyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl hexyl ester. Diethylmalonic acid, di(2,6-dimethoxyphenyl) ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl octyl ester. Diethylmalonic acid, dodecyl 4-fluoro-2-methoxyphenyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl tetradecyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl undecyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl pentadecyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl tridecyl ester. Diethylmalonic acid, 4-fluoro-2-methoxyphenyl heptyl ester. 2-Ethylbutyric acid, 4-fluoro-2-methoxyphenyl ester.

Find more compounds similar to Diethylmalonic acid, di(4-fluoro-2-methoxyphenyl) ester.

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