CAS
913836-08-5 Purity
98%
913836-08-5 Purity
98%
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Specification
The molecular formula is C6H7BClNO2.
The molecular weight is 171.39 g/mol.
The IUPAC name is (6-chloro-2-methylpyridin-3-yl)boronic acid.
The InChI is InChI=1S/C6H7BClNO2/c1-4-5(7(10)11)2-3-6(8)9-4/h2-3,10-11H,1H3.
The InChIKey is WEKRUIAZOLIAOG-UHFFFAOYSA-N.
The canonical SMILES is B(C1=C(N=C(C=C1)Cl)C)(O)O.
The CAS number is 913836-15-4.
The EC number is 691-024-6.
Yes, it is a canonicalized compound.