Chemical Properties of Glutaric acid, pentadecyl 2,3,6-trifluorobenzyl ester

Glutaric acid, pentadecyl 2,3,6-trifluorobenzyl ester

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InChI
InChI=1S/C27H41F3O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-20-33-25(31)16-15-17-26(32)34-21-22-23(28)18-19-24(29)27(22)30/h18-19H,2-17,20-21H2,1H3
InChI Key
LGSALPVTKPQNJT-UHFFFAOYSA-N
Formula
C27H41F3O4
SMILES
CCCCCCCCCCCCCCCOC(=O)CCCC(=O)OCc1c(F)ccc(F)c1F
Molecular Weight1
486.61
Sources

Physical Properties

Property Value Unit Source
Δf -792.29 kJ/mol Joback Calculated Property
Δfgas -1476.42 kJ/mol Joback Calculated Property
Δfus 73.37 kJ/mol Joback Calculated Property
Δvap 95.82 kJ/mol Joback Calculated Property
logPoct/wat 7.95 Crippen Calculated Property
Pc 785.95 kPa Joback Calculated Property
Tboil 1009.17 K Joback Calculated Property
Tc 1247.41 K Joback Calculated Property
Tfus 604.12 K Joback Calculated Property
Vc 1.54 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1325.28 J/mol×K 1009.17 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-F 3
=CH- (ring) 2
=C< (ring) 4
-CH2- 18
-CH3 1
>C=O (nonring) 2

Similar Compounds

Glutaric acid, nonyl 2,3,6-trifluorobenzyl ester. Glutaric acid, octadecyl 2,3,6-trifluorobenzyl ester. Glutaric acid, tetradecyl 2,3,6-trifluorobenzyl ester. Glutaric acid, heptyl 2,3,6-trifluorobenzyl ester. Glutaric acid, hexyl 2,3,6-trifluorobenzyl ester. Glutaric acid, pentyl 2,3,6-trifluorobenzyl ester. Glutaric acid, butyl 2,3,6-trifluorobenzyl ester. Glutaric acid, propyl 2,3,6-trifluorobenzyl ester. Sebacic acid, decyl 2,3,6-trifluorobenzyl ester. Glutaric acid, pentafluorobenzyl tetradecyl ester. Glutaric acid, octadecyl pentafluorobenzyl ester. Glutaric acid, decyl pentafluorobenzyl ester. Glutaric acid, pentafluorobenzyl tridecyl ester. Glutaric acid, pentadecyl pentafluorobenzyl ester. Glutaric acid, heptyl pentafluorobenzyl ester.

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