CAS
92899-33-7 Purity
96%
92899-33-7 Purity
96%
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Specification
The molecular formula is C7H6ClN3.
The molecular weight is 167.59 g/mol.
The IUPAC name is 8-chloro-3-methyl-[1,2,4]triazolo[4,3-a]pyridine.
The InChI is InChI=1S/C7H6ClN3/c1-5-9-10-7-6(8)3-2-4-11(5)7/h2-4H,1H3.
The InChIKey is IYHIDEHLMBFMAW-UHFFFAOYSA-N.
The Canonical SMILES is CC1=NN=C2N1C=CC=C2Cl.
The CAS number is 929000-42-0.
The XLogP3-AA value is 2.2.
There are 2 hydrogen bond acceptors.
Yes, the compound is canonicalized in PubChem.