Chemical Properties of Glutaric acid, di(1-(2,6-difluorophenyl)ethyl) ester

Glutaric acid, di(1-(2,6-difluorophenyl)ethyl) ester

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InChI
InChI=1S/C21H20F4O4/c1-12(20-14(22)6-3-7-15(20)23)28-18(26)10-5-11-19(27)29-13(2)21-16(24)8-4-9-17(21)25/h3-4,6-9,12-13H,5,10-11H2,1-2H3
InChI Key
CHIFOAZRJHRVLT-UHFFFAOYSA-N
Formula
C21H20F4O4
SMILES
CC(OC(=O)CCCC(=O)OC(C)c1c(F)cccc1F)c1c(F)cccc1F
Molecular Weight1
412.37
Sources

Physical Properties

Property Value Unit Source
Δf -939.72 kJ/mol Joback Calculated Property
Δfgas -1334.19 kJ/mol Joback Calculated Property
Δfus 47.52 kJ/mol Joback Calculated Property
Δvap 83.81 kJ/mol Joback Calculated Property
logPoct/wat 5.32 Crippen Calculated Property
Pc 1367.69 kPa Joback Calculated Property
Tboil 901.94 K Joback Calculated Property
Tc 1112.05 K Joback Calculated Property
Tfus 546.03 K Joback Calculated Property
Vc 1.10 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 865.81 J/mol×K 901.94 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
>CH- 2
-F 4
=CH- (ring) 6
=C< (ring) 6
-CH2- 3
-CH3 2
>C=O (nonring) 2

Similar Compounds

Glutaric acid, 1-(2,6-difluorophenyl)ethyl ethyl ester. Glutaric acid, 1-(2,6-difluorophenyl)ethyl undecyl ester. Glutaric acid, 1-(2,6-difluorophenyl)ethyl tridecyl ester. Glutaric acid, 1-(2,6-difluorophenyl)ethyl hexadecyl ester. Glutaric acid, 1-(2,6-difluorophenyl)ethyl dodecyl ester. Glutaric acid, ethyl 1-(2-fluorophenyl)ethyl ester. Glutaric acid, 1-(2-fluorophenyl)ethyl propyl ester. Glutaric acid, butyl 1-(2-fluorophenyl)ethyl ester. Glutaric acid, 1-(2-fluorophenyl)ethyl pentyl ester. Glutaric acid, 1-(2-fluorophenyl)ethyl hexyl ester. Glutaric acid, 1-(2-fluorophenyl)ethyl heptyl ester. Glutaric acid, decyl 1-(2-fluorophenyl)ethyl ester. Glutaric acid, 1-(2-fluorophenyl)ethyl nonyl ester. Glutaric acid, 1-(2-fluorophenyl)ethyl isobutyl ester. Sebacic acid, di(1-(2-fluorophenyl)ethyl) ester.

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