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The molecular formula is C6H6BrNO2S.
The molecular weight is 236.09 g/mol.
The IUPAC name is 2-bromo-5-methylsulfonylpyridine.
The InChI is InChI=1S/C6H6BrNO2S/c1-11(9,10)5-2-3-6(7)8-4-5/h2-4H,1H3.
The InChIKey is ZRXQHWYUAIXKRL-UHFFFAOYSA-N.
The Canonical SMILES is CS(=O)(=O)C1=CN=C(C=C1)Br.
The CAS number is 343262-51-1.
The XLogP3-AA value is 1.1.
Yes, 2-Bromo-5-(methylsulfonyl)pyridine is a canonicalized compound.
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