CAS
6945-67-1 Purity
98%
6945-67-1 Purity
98%
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The molecular formula is C7H3BrClF3.
The molecular weight is 259.45 g/mol.
The IUPAC name is 1-bromo-3-chloro-5-(trifluoromethyl)benzene.
The InChI is InChI=1S/C7H3BrClF3/c8-5-1-4(7(10,11)12)2-6(9)3-5/h1-3H.
The InChIKey is QRPRXRQFNNXPBA-UHFFFAOYSA-N.
The Canonical SMILES is C1=C(C=C(C=C1Cl)Br)C(F)(F)F.
The CAS number is 928783-85-1.
The EC number is 674-747-1.
Yes, it is a canonicalized compound according to PubChem.