92-33-1 Purity
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Specification
The molecular formula is C8H8BrN3.
The molecular weight is 226.07 g/mol.
Some synonyms include 92336-10-2, 6-Bromo-5,7-dimethyl-3H-imidazo[4,5-b]pyridine, and DTXSID50598725.
It was created on December 4, 2007.
The IUPAC name is 6-bromo-5,7-dimethyl-1H-imidazo[4,5-b]pyridine.
The InChI is InChI=1S/C8H8BrN3/c1-4-6(9)5(2)12-8-7(4)10-3-11-8/h3H,1-2H3,(H,10,11,12).
The InChIKey is MRUMPPMLGSGFAK-UHFFFAOYSA-N.
The Canonical SMILES is CC1=C2C(=NC(=C1Br)C)N=CN2.
It has 1 hydrogen bond donor count.
Yes, it is a canonicalized compound.