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

Diethylmalonic acid, 3,4-difluorobenzyl hexadecyl ester

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InChI
InChI=1S/C30H48F2O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-22-35-28(33)30(5-2,6-3)29(34)36-24-25-20-21-26(31)27(32)23-25/h20-21,23H,4-19,22,24H2,1-3H3
InChI Key
KKPDHHKAWLEZSP-UHFFFAOYSA-N
Formula
C30H48F2O4
SMILES
CCCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)OCc1ccc(F)c(F)c1
Molecular Weight1
510.70
Sources

Physical Properties

Property Value Unit Source
Δf -559.75 kJ/mol Joback Calculated Property
Δfgas -1339.51 kJ/mol Joback Calculated Property
Δfus 71.04 kJ/mol Joback Calculated Property
Δvap 101.36 kJ/mol Joback Calculated Property
logPoct/wat 8.84 Crippen Calculated Property
Pc 701.35 kPa Joback Calculated Property
Tboil 1070.33 K Joback Calculated Property
Tc 1328.66 K Joback Calculated Property
Tfus 627.24 K Joback Calculated Property
Vc 1.68 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1509.00 J/mol×K 1070.33 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-CH3 3
=CH- (ring) 3
=C< (ring) 3
-CH2- 18
-F 2
>C< 1
>C=O (nonring) 2

Similar Compounds

Diethylmalonic acid, 3,4-difluorobenzyl octadecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl octyl ester. Diethylmalonic acid, 3,4-difluorobenzyl undecyl ester. Diethylmalonic acid, 3,4-difluorobenzyl hexyl ester. Diethylmalonic acid, butyl 3,4,5-trifluorobenzyl ester. Diethylmalonic acid, ethyl 3,4,5-trifluorobenzyl ester. Diethylmalonic acid, dodecyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, octadecyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, decyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, pentadecyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, tridecyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, 2,4,5-trifluorobenzyl undecyl ester. Diethylmalonic acid, pentyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, butyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, propyl 2,4,5-trifluorobenzyl ester.

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

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