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The molecular formula is C9H8BNO2.
The molecular weight is 172.98 g/mol.
The IUPAC name is isoquinolin-8-ylboronic acid.
The InChI is InChI=1S/C9H8BNO2/c12-10(13)9-3-1-2-7-4-5-11-6-8(7)9/h1-6,12-13H.
The InChIKey is RKCMKNFWHLIGSF-UHFFFAOYSA-N.
The canonical SMILES is B(C1=C2C=NC=CC2=CC=C1)(O)O.
The CAS number is 721401-43-0.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 3.
Yes, it is considered a canonical compound.
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