CAS
206872-01-7 Purity
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206872-01-7 Purity
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The molecular formula is C8H9BrN2O.
The molecular weight is 229.07 g/mol.
The IUPAC name is 6-bromo-N-ethylpyridine-3-carboxamide.
The InChI is InChI=1S/C8H9BrN2O/c1-2-10-8(12)6-3-4-7(9)11-5-6/h3-5H,2H2,1H3,(H,10,12).
The InChIKey is YZKAGMRJEOWXIP-UHFFFAOYSA-N.
The canonical SMILES is CCNC(=O)C1=CN=C(C=C1)Br.
The CAS number is 951885-70-4.
The XLogP3 value is 1.3.
It has 1 hydrogen bond donor count.
It has 2 hydrogen bond acceptor counts.