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The molecular formula is C9H11BrClNO.
The molecular weight is 264.54 g/mol.
The IUPAC name is 6-bromo-3,4-dihydro-1H-isochromen-4-amine hydrochloride.
The InChI is InChI=1S/C9H10BrNO.ClH/c10-7-2-1-6-4-12-5-9(11)8(6)3-7;/h1-3,9H,4-5,11H2;1H.
The InChIKey is ZMGMZLVFQWJVGW-UHFFFAOYSA-N.
The canonical SMILES is C1C(C2=C(CO1)C=CC(=C2)Br)N.Cl.
The CAS number is 676134-73-9.
The hydrogen bond donor count is 2.
The hydrogen bond acceptor count is 2.
The topological polar surface area is 35.2Ų.
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