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Specification
The molecular formula of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is C8H5BrF4.
The molecular weight of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is 257.02 g/mol.
The IUPAC name of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is 1-(bromomethyl)-3-fluoro-5-(trifluoromethyl)benzene.
The InChI of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is InChI=1S/C8H5BrF4/c9-4-5-1-6(8(11,12)13)3-7(10)2-5/h1-3H,4H2.
The InChIKey of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is LCVWAXYGYMZJER-UHFFFAOYSA-N.
The canonical SMILES of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is C1=C(C=C(C=C1C(F)(F)F)F)CBr.
The CAS number of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is 239087-09-3.
The European Community (EC) number of 3-Fluoro-5-(trifluoromethyl)benzyl bromide is 671-104-7.
Yes, 3-Fluoro-5-(trifluoromethyl)benzyl bromide is a canonicalized compound.