CAS
30841-93-1 Purity
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30841-93-1 Purity
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The molecular formula is C9H7BrN2O2.
The molecular weight is 255.07 g/mol.
The IUPAC name is methyl 3-bromo-1H-pyrrolo[3,2-b]pyridine-2-carboxylate.
The InChI is InChI=1S/C9H7BrN2O2/c1-14-9(13)8-6(10)7-5(12-8)3-2-4-11-7/h2-4,12H,1H3.
The InChIKey is FSYGBFGZKCJGCW-UHFFFAOYSA-N.
The canonical SMILES is COC(=O)C1=C(C2=C(N1)C=CC=N2)Br.
The CAS number is 952182-30-8.
It has 1 hydrogen bond donor count.
It has 3 hydrogen bond acceptor counts.