Chemical Properties of Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl nonyl ester

Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl nonyl ester

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InChI
InChI=1S/C19H32BrF3O4/c1-4-7-8-9-10-11-12-13-26-16(24)18(5-2,6-3)17(25)27-15(14-20)19(21,22)23/h15H,4-14H2,1-3H3
InChI Key
OIIGMPVTPDFKGL-UHFFFAOYSA-N
Formula
C19H32BrF3O4
SMILES
CCCCCCCCCOC(=O)C(CC)(CC)C(=O)OC(CBr)C(F)(F)F
Molecular Weight1
461.35
Sources

Physical Properties

Property Value Unit Source
Δf -925.61 kJ/mol Joback Calculated Property
Δfgas -1509.87 kJ/mol Joback Calculated Property
Δfus 46.71 kJ/mol Joback Calculated Property
Δvap 77.20 kJ/mol Joback Calculated Property
logPoct/wat 5.96 Crippen Calculated Property
Pc 1133.67 kPa Joback Calculated Property
Tboil 843.77 K Joback Calculated Property
Tc 1035.73 K Joback Calculated Property
Tfus 499.62 K Joback Calculated Property
Vc 1.24 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 980.95 J/mol×K 843.77 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
>CH- 1
-O- (nonring) 2
-CH3 3
-CH2- 11
-F 3
>C< 2
>C=O (nonring) 2
-Br 1

Similar Compounds

Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl heptadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl tetradecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl octadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl tridecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl dodecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl heptyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl octyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl undecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl decyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl isobutyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl ethyl ester.

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