CAS
202865-59-6 Purity
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202865-59-6 Purity
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The molecular formula is C7H3Br3N2O.
The structure was created on 2007-12-05.
The IUPAC name is 3,3,5-tribromo-1H-pyrrolo[2,3-b]pyridin-2-one.
The Canonical SMILES is C1=C(C=NC2=C1C(C(=O)N2)(Br)Br)Br.
The molecular weight is 370.82 g/mol.
The compound has 1 hydrogen bond donor count.
The topological polar surface area is 42 Ų.
Yes, the compound is canonicalized.
The XLogP3-AA value is 2.3.
The compound contains 13 heavy atoms.