Chemical Properties of Dimethylmalonic acid, di(1-bromo-3,3,3-trifluoroprop-2-yl) ester

Dimethylmalonic acid, di(1-bromo-3,3,3-trifluoroprop-2-yl) ester

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InChI
InChI=1S/C11H12Br2F6O4/c1-9(2,7(20)22-5(3-12)10(14,15)16)8(21)23-6(4-13)11(17,18)19/h5-6H,3-4H2,1-2H3
InChI Key
SAIFPIKBRNLLGC-UHFFFAOYSA-N
Formula
C11H12Br2F6O4
SMILES
CC(C)(C(=O)OC(CBr)C(F)(F)F)C(=O)OC(CBr)C(F)(F)F
Molecular Weight1
482.01
Sources

Physical Properties

Property Value Unit Source
Δf -1562.68 kJ/mol Joback Calculated Property
Δfgas -1920.78 kJ/mol Joback Calculated Property
Δfus 29.58 kJ/mol Joback Calculated Property
Δvap 61.70 kJ/mol Joback Calculated Property
logPoct/wat 3.75 Crippen Calculated Property
Pc 1991.21 kPa Joback Calculated Property
Tboil 721.03 K Joback Calculated Property
Tc 911.60 K Joback Calculated Property
Tfus 458.45 K Joback Calculated Property
Vc 0.89 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 601.35 J/mol×K 721.03 Joback Calculated Property

Molecular Descriptors

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

Similar Compounds

Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentyl ester. Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexyl ester. Dimethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl isohexyl ester. Diethylmalonic acid, di(1-bromo-3,3,3-trifluoroprop-2-yl) ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl ethyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl isobutyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl hexyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl octadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl pentadecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl tetradecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl nonyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl decyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl tridecyl ester. Diethylmalonic acid, 1-bromo-3,3,3-trifluoroprop-2-yl undecyl ester.

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