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The IUPAC name is 3-(3-methyl-1,2,4-oxadiazol-5-yl)benzoyl chloride.
The molecular formula is C10H7ClN2O2.
The molecular weight is 222.63 g/mol.
The InChI is InChI=1S/C10H7ClN2O2/c1-6-12-10(15-13-6)8-4-2-3-7(5-8)9(11)14/h2-5H,1H3.
The InChIKey is OSKVPCDSIORYNO-UHFFFAOYSA-N.
The Canonical SMILES is CC1=NOC(=N1)C2=CC(=CC=C2)C(=O)Cl.
It has 4 hydrogen bond acceptor count.
The topological polar surface area is 56 Ų.
Yes, the compound is canonicalized.
It was created on 2008-02-29 and last modified on 2023-12-30.
915707-42-5
915707-44-7
915707-45-8
915707-48-1
915707-49-2
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