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The molecular formula is C8H6BrF3.
The molecular weight is 239.03 g/mol.
The IUPAC name is 2-bromo-1-methyl-4-(trifluoromethyl)benzene.
The InChI code is InChI=1S/C8H6BrF3/c1-5-2-3-6(4-7(5)9)8(10,11)12/h2-4H,1H3.
The InChIKey is TWWUWLMGYSLODU-UHFFFAOYSA-N.
The Canonical SMILES is CC1=C(C=C(C=C1)C(F)(F)F)Br.
The CAS number is 66417-30-9.
The XLogP3-AA value is 3.9.
Yes, it is considered as a canonicalized compound.
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