CAS
476335-19-0 Purity
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476335-19-0 Purity
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The molecular formula is C6H7BClNO3.
The molecular weight is 187.39 g/mol.
It was created on July 26, 2010.
The IUPAC name is (6-chloro-4-methoxypyridin-3-yl)boronic acid.
The InChI is InChI=1S/C6H7BClNO3/c1-12-5-2-6(8)9-3-4(5)7(10)11/h2-3,10-11H,1H3.
The InChIKey is XZYKMRJYFUEGON-UHFFFAOYSA-N.
The canonical SMILES is B(C1=CN=C(C=C1OC)Cl)(O)O.
The CAS number is 1072946-20-3.
It has 2 hydrogen bond donor counts.
The topological polar surface area is 62.6Ų.