Chemical Properties of Diethylmalonic acid, di(2,2,3,3,4,4,5,5-octafluoropentyl) ester

Diethylmalonic acid, di(2,2,3,3,4,4,5,5-octafluoropentyl) ester

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InChI
InChI=1S/C17H16F16O4/c1-3-11(4-2,9(34)36-5-12(22,23)16(30,31)14(26,27)7(18)19)10(35)37-6-13(24,25)17(32,33)15(28,29)8(20)21/h7-8H,3-6H2,1-2H3
InChI Key
UARSSTLFGUXQGB-UHFFFAOYSA-N
Formula
C17H16F16O4
SMILES
CCC(CC)(C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F)C(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
Molecular Weight1
588.28
Sources

Physical Properties

Property Value Unit Source
Δf -3477.54 kJ/mol Joback Calculated Property
Δfgas -4093.38 kJ/mol Joback Calculated Property
Δfus 35.70 kJ/mol Joback Calculated Property
Δvap 48.83 kJ/mol Joback Calculated Property
logPoct/wat 6.22 Crippen Calculated Property
Pc 902.34 kPa Joback Calculated Property
Tboil 705.77 K Joback Calculated Property
Tc 864.21 K Joback Calculated Property
Tfus 422.05 K Joback Calculated Property
Vc 1.23 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 930.68 J/mol×K 705.77 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 2
-O- (nonring) 2
-F 16
>C=O (nonring) 2
-CH2- 4
>C< 7
-CH3 2

Similar Compounds

Diethylmalonic acid, pentyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Diethylmalonic acid, butyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Diethylmalonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl heptyl ester. Diethylmalonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tetradecyl ester. Diethylmalonic acid, decyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Diethylmalonic acid, 2,2,3,3,4,4,5,5-octafluoropentyl tridecyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl propyl ester. Diethylmalonic acid, ethyl 2,2,3,3,4,4,4-heptafluorobutyl ester. Diethylmalonic acid, di(2,2,3,3,4,4,4-heptafluorobutyl) ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl nonyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl tridecyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexadecyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl heptyl ester. Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl undecyl ester. Diethylmalonic acid, monochloride, 2,2,3,3,4,4,5,5-octafluoropentyl ester.

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