CAS
349-03-1 Purity
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349-03-1 Purity
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The molecular formula is C7H3BrClF3O2S.
The molecular weight is 323.52 g/mol.
The IUPAC name is 3-bromo-5-(trifluoromethyl)benzenesulfonyl chloride.
The InChI is InChI=1S/C7H3BrClF3O2S/c8-5-1-4(7(10,11)12)2-6(3-5)15(9,13)14/h1-3H.
The InChIKey is YBUJCZFWJSUTSN-UHFFFAOYSA-N.
The canonical SMILES is C1=C(C=C(C=C1S(=O)(=O)Cl)Br)C(F)(F)F.
The CAS number is 351003-46-8.
The EC number is 624-198-9.
Yes, it is a canonicalized compound.