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The molecular formula is C6H3BrIN3.
The molecular weight is 323.92 g/mol.
The IUPAC name is 5-bromo-3-iodo-2H-pyrazolo[3,4-b]pyridine.
The InChI is InChI=1S/C6H3BrIN3/c7-3-1-4-5(8)10-11-6(4)9-2-3/h1-2H,(H,9,10,11).
The InChI key is ZBPXFBHBTCYAQS-UHFFFAOYSA-N.
The canonical SMILES is C1=C(C=NC2=NNC(=C21)I)Br.
The CAS number is 875781-18-3.
The XLogP3-AA is 2.2.
The hydrogen bond donor count is 1.
The hydrogen bond acceptor count is 2.
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