923241-54-7 Purity
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The IUPAC name of the compound is 2-(5-bromopyridin-3-yl)-4,4-dimethyl-5H-1,3-oxazole.
The InChI of the compound is InChI=1S/C10H11BrN2O/c1-10(2)6-14-9(13-10)7-3-8(11)5-12-4-7/h3-5H,6H2,1-2H3.
The InChIKey of the compound is VIJTTXXSRAHRJP-UHFFFAOYSA-N.
The Canonical SMILES of the compound is CC1(COC(=N1)C2=CC(=CN=C2)Br)C.
The molecular formula of the compound is C10H11BrN2O.
The molecular weight of the compound is 255.11 g/mol.
The compound has 3 hydrogen bond acceptors.
The topological polar surface area of the compound is 34.5 Ų.
There are 14 heavy atoms in the compound.
Yes, the compound is canonicalized.