Chemical Properties of Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexadecyl ester

Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl hexadecyl ester

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InChI
InChI=1S/C27H45F7O4/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-37-22(35)24(5-2,6-3)23(36)38-21-25(28,29)26(30,31)27(32,33)34/h4-21H2,1-3H3
InChI Key
MBRJCEPIVGMNMG-UHFFFAOYSA-N
Formula
C27H45F7O4
SMILES
CCCCCCCCCCCCCCCCOC(=O)C(CC)(CC)C(=O)OCC(F)(F)C(F)(F)C(F)(F)F
Molecular Weight1
566.63
Sources

Physical Properties

Property Value Unit Source
Δf -1643.69 kJ/mol Joback Calculated Property
Δfgas -2497.98 kJ/mol Joback Calculated Property
Δfus 63.16 kJ/mol Joback Calculated Property
Δvap 83.10 kJ/mol Joback Calculated Property
logPoct/wat 9.19 Crippen Calculated Property
Pc 638.66 kPa Joback Calculated Property
Tboil 951.71 K Joback Calculated Property
Tc 1184.03 K Joback Calculated Property
Tfus 552.18 K Joback Calculated Property
Vc 1.68 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 1456.22 J/mol×K 951.71 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-O- (nonring) 2
-F 7
>C=O (nonring) 2
-CH2- 18
>C< 4
-CH3 3

Similar Compounds

Diethylmalonic acid, 2,2,3,3,4,4,4-heptafluorobutyl tridecyl 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, 2,2,3,3,4,4,4-heptafluorobutyl nonyl ester. Diethylmalonic acid, di(2,2,3,3,4,4,4-heptafluorobutyl) 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, 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, butyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Diethylmalonic acid, pentyl 2,2,3,3,4,4,5,5-octafluoropentyl ester. Diethylmalonic acid, di(2,2,3,3,4,4,5,5-octafluoropentyl) ester. Dimethylmalonic acid, 2,2,3,4,4,4-hexafluorobutyl nonyl ester.

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