CAS
4761-00-6 Purity
96%
4761-00-6 Purity
96%
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Specification
The molecular formula is C7H6BrN3.
The molecular weight is 212.05 g/mol.
The IUPAC name is 3-bromo-2H-indazol-5-amine.
The InChI is InChI=1S/C7H6BrN3/c8-7-5-3-4(9)1-2-6(5)10-11-7/h1-3H,9H2,(H,10,11).
The InChIKey is AOKHRTSXJINPPJ-UHFFFAOYSA-N.
The canonical SMILES is C1=CC2=NNC(=C2C=C1N)Br.
The CAS number is 478837-59-1.
The ChEMBL ID is CHEMBL4871572.
Yes, 3-Bromo-1H-indazol-5-amine is a canonicalized compound.