CAS
400-72-6 Purity
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400-72-6 Purity
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The molecular formula is C6H6BrNO.
The molecular weight is 188.02 g/mol.
The IUPAC name is 2-bromo-6-methoxypyridine.
The InChI is InChI=1S/C6H6BrNO/c1-9-6-4-2-3-5(7)8-6/h2-4H,1H3.
The InChIKey is KMODISUYWZPVGV-UHFFFAOYSA-N.
The Canonical SMILES is COC1=NC(=CC=C1)Br.
The CAS number is 40473-07-2.
The EC number is 628-883-3.
The DSSTox Substance ID is DTXSID90292619.
Yes, 2-Bromo-6-methoxy-pyridine is a canonicalized compound.