Chemical Properties of 3,5-Bis(trifluoromethyl)benzyl bromide (CAS 32247-96-4)

3,5-Bis(trifluoromethyl)benzyl bromide

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InChI
InChI=1S/C9H5BrF6/c10-4-5-1-6(8(11,12)13)3-7(2-5)9(14,15)16/h1-3H,4H2
InChI Key
ATLQGZVLWOURFU-UHFFFAOYSA-N
Formula
C9H5BrF6
SMILES
FC(F)(F)c1cc(CBr)cc(C(F)(F)F)c1
Molecular Weight1
307.03
CAS
32247-96-4
Other Names
  • 1-(bromomethyl)-3,5-bis(trifluoromethyl)benzene
  • 3,5-di(Trifluoromethyl)benzyl bromide
  • Benzene, 1-(bromomethyl)-3,5-bis(trifluoromethyl)-
Sources

Physical Properties

Property Value Unit Source
Δf -1030.81 kJ/mol Joback Calculated Property
Δfgas -1183.33 kJ/mol Joback Calculated Property
Δfus 21.27 kJ/mol Joback Calculated Property
Δvap 38.17 kJ/mol Joback Calculated Property
logPoct/wat 4.62 Crippen Calculated Property
Pc 2646.11 kPa Joback Calculated Property
Tboil 497.28 K Joback Calculated Property
Tc 685.79 K Joback Calculated Property
Tfus 310.83 K Joback Calculated Property
Vc 0.58 m3/kg-mol Joback Calculated Property

Temperature Dependent Properties

Property Value Unit Temperature (K) Source
Cp,gas 311.27 J/mol×K 497.28 Joback Calculated Property

Molecular Descriptors

Joback and Reid Groups
-F 6
=CH- (ring) 3
=C< (ring) 3
-CH2- 1
>C< 2
-Br 1

Similar Compounds

3-Trifluoromethylbenzyl bromide. 1,3,5-Tris(trifluoromethyl)benzene. Benzene, 1,3-bis(trifluoromethyl)-. 1-Ethynyl-3,5-bis(trifluoromethyl)benzene. 2,4-Bis(trifluoromethyl)benzyl bromide. 4-Trifluoromethylbenzyl bromide. 3,5-Bis(trifluoromethyl)benzylamine. 3,5-Bis(trifluoromethyl)benzyl alcohol. 3-CF3-C6H4-CCH. 3,5-Bis(trifluoromethyl)benzyl chloride. 3,5-Bis(trifluoromethyl)benzaldehyde. Benzonitrile, 3,5-bis(trifluoromethyl)-. m-(Trifluoromethyl)benzyl alcohol. M-trifluoromethylbenzyl mercaptan. Benzene, 1-(chloromethyl)-3-(trifluoromethyl)-.

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