3156-34-1 Purity
96%
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Specification
The chemical formula of the compound is C6H4BrN3.
The molecular weight of the compound is 198.02 g/mol.
The IUPAC name of the compound is 6-bromo-[1,2,4]triazolo[1,5-a]pyridine.
The InChI of the compound is InChI=1S/C6H4BrN3/c7-5-1-2-6-8-4-9-10(6)3-5/h1-4H.
The InChIKey of the compound is CXRXKDSDRWLKTK-UHFFFAOYSA-N.
The canonical SMILES of the compound is C1=CC2=NC=NN2C=C1Br.
The CAS number of the compound is 356560-80-0.
The XLogP3-AA value of the compound is 1.4.
The compound has 0 hydrogen bond donor counts.
The compound has 2 hydrogen bond acceptor counts.