445-01-2 Purity
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The molecular formula of 4-Bromoisoquinoline is C9H6BrN.
The molecular weight of 4-Bromoisoquinoline is 208.05 g/mol.
The IUPAC name of 4-Bromoisoquinoline is 4-bromoisoquinoline.
The InChI of 4-Bromoisoquinoline is InChI=1S/C9H6BrN/c10-9-6-11-5-7-3-1-2-4-8(7)9/h1-6H.
The InChIKey of 4-Bromoisoquinoline is SCRBSGZBTHKAHU-UHFFFAOYSA-N.
The canonical SMILES of 4-Bromoisoquinoline is C1=CC=C2C(=C1)C=NC=C2Br.
The CAS number of 4-Bromoisoquinoline is 1532-97-4.
The European Community (EC) Number of 4-Bromoisoquinoline is 216-244-8.
The DSSTox Substance ID of 4-Bromoisoquinoline is DTXSID00165284.
Yes, 4-Bromoisoquinoline is a canonicalized compound.