907193-65-1 Purity
96%
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The molecular formula is C12H12ClNO.
The molecular weight is 221.68 g/mol.
The IUPAC name is 2-[chloro(phenyl)methyl]-4,5-dimethyl-1,3-oxazole.
The InChI is InChI=1S/C12H12ClNO/c1-8-9(2)15-12(14-8)11(13)10-6-4-3-5-7-10/h3-7,11H,1-2H3.
The InChIKey is HJTHRYJGVOYVAN-UHFFFAOYSA-N.
The Canonical SMILES is CC1=C(OC(=N1)C(C2=CC=CC=C2)Cl)C.
2-(Chlorophenylmethyl)-4,5-dimethyloxazole has 0 hydrogen bond donor count.
The exact mass is 221.0607417 g/mol.
2-(Chlorophenylmethyl)-4,5-dimethyloxazole has 2 rotatable bond counts.
Yes, the compound is canonicalized.