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The molecular formula is C6H3BrN2O.
The molecular weight is 199.00 g/mol.
The IUPAC name is 5-bromo-2-oxo-1H-pyridine-3-carbonitrile.
The InChI is InChI=1S/C6H3BrN2O/c7-5-1-4(2-8)6(10)9-3-5/h1,3H,(H,9,10).
The InChIKey is SWTLLSLCDHXNIU-UHFFFAOYSA-N.
The canonical SMILES is C1=C(C(=O)NC=C1Br)C#N.
The CAS number is 405224-22-8.
The EC number is 800-559-8.
The DSSTox Substance ID is DTXSID10428392.
Yes, 5-Bromo-2-hydroxynicotinonitrile is canonicalized.
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