202865-69-8 Purity
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Specification
The molecular formula is C8H9BrClN.
The molecular weight is 234.52 g/mol.
The IUPAC name is 5-bromo-2,3-dihydro-1H-isoindole;hydrochloride.
The InChI is InChI=1S/C8H8BrN.ClH/c9-8-2-1-6-4-10-5-7(6)3-8;/h1-3,10H,4-5H2;1H.
The InChIKey is GDMXNYRWVLBUDZ-UHFFFAOYSA-N.
The canonical SMILES is C1C2=C(CN1)C=C(C=C2)Br.Cl.
The CAS number is 919346-89-7.
The European Community (EC) number is 823-543-2.
Yes, it is considered as a canonicalized compound.
Reference: [1] Patent: CN107474006, 2017, A, . Location in patent: Paragraph 0050; 0051; 0055; 0056; 0057; 0061-0063; 0067
Reference: [1] Patent: US2009/143372, 2009, A1,
Reference: [1] Patent: CN107474006, 2017, A,
Reference: [1]Current Patent Assignee: GLAXOSMITHKLINE PLC - US2009/143372, 2009, A1
Reference: [1]Patent: CN107474006,2017,A .Location in patent: Paragraph 0050; 0051; 0055; 0056; 0057; 0061-0063; 0067