1162262-39-6 Purity
96%
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Specification
The molecular formula of 5-Benzyloxypyridine-3-boronic acid is C12H12BNO3.
The molecular weight of 5-Benzyloxypyridine-3-boronic acid is 229.04 g/mol.
The IUPAC name of 5-Benzyloxypyridine-3-boronic acid is (5-phenylmethoxypyridin-3-yl)boronic acid.
The InChI code of 5-Benzyloxypyridine-3-boronic acid is InChI=1S/C12H12BNO3/c15-13(16)11-6-12(8-14-7-11)17-9-10-4-2-1-3-5-10/h1-8,15-16H,9H2.
The InChIKey of 5-Benzyloxypyridine-3-boronic acid is IGKYPUBWQHKLLC-UHFFFAOYSA-N.
The canonical SMILES of 5-Benzyloxypyridine-3-boronic acid is B(C1=CC(=CN=C1)OCC2=CC=CC=C2)(O)O.
The CAS number of 5-Benzyloxypyridine-3-boronic acid is 1190423-61-0.
The ChEMBL ID of 5-Benzyloxypyridine-3-boronic acid is CHEMBL3417360.
The DSSTox Substance ID of 5-Benzyloxypyridine-3-boronic acid is DTXSID00694488.
Yes, 5-Benzyloxypyridine-3-boronic acid is a canonicalized compound.