Chemical Properties of Diethylmalonic acid, heptadecyl pentafluorobenzyl ester

Diethylmalonic acid, heptadecyl pentafluorobenzyl ester

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InChI
InChI=1S/C31H47F5O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-39-29(37)31(5-2,6-3)30(38)40-22-23-24(32)26(34)28(36)27(35)25(23)33/h4-22H2,1-3H3
InChI Key
SKZPOKCVJORIBX-UHFFFAOYSA-N
Formula
C31H47F5O4
SMILES
CCCCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)OCc1c(F)c(F)c(F)c(F)c1F
Molecular Weight1
578.69
Sources

Physical Properties

Property Value Unit Source
Δf -1164.65 kJ/mol Joback Calculated Property
Δfgas -1982.89 kJ/mol Joback Calculated Property
Δfus 81.70 kJ/mol Joback Calculated Property
Δvap 103.12 kJ/mol Joback Calculated Property
logPoct/wat 9.65 Crippen Calculated Property
Pc 609.06 kPa Joback Calculated Property
Tboil 1105.96 K Joback Calculated Property
Tc 1407.69 K Joback Calculated Property
Tfus 677.84 K Joback Calculated Property
Vc 1.79 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1589.15 J/mol×K 1105.96 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-F 5
>C=O (nonring) 2
=C< (ring) 6
-CH2- 19
>C< 1
-CH3 3

Similar Compounds

Diethylmalonic acid, pentadecyl pentafluorobenzyl ester. Diethylmalonic acid, decyl pentafluorobenzyl ester. Diethylmalonic acid, eicosyl pentafluorobenzyl ester. Diethylmalonic acid, hexadecyl pentafluorobenzyl ester. Diethylmalonic acid, pentafluorobenzyl tetradecyl ester. Diethylmalonic acid, pentafluorobenzyl undecyl ester. Diethylmalonic acid, octadecyl pentafluorobenzyl ester. Diethylmalonic acid, octyl pentafluorobenzyl ester. Diethylmalonic acid, butyl pentafluorobenzyl ester. Diethylmalonic acid, isobutyl pentafluorobenzyl ester. Diethylmalonic acid, tridecyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, decyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, dodecyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, octadecyl 2,4,5-trifluorobenzyl ester. Diethylmalonic acid, 2,4,5-trifluorobenzyl undecyl ester.

Find more compounds similar to Diethylmalonic acid, heptadecyl pentafluorobenzyl ester.

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