CAS
76008-73-6 Purity
97.0%(GC)
76008-73-6 Purity
97.0%(GC)
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Specification
The molecular formula is C6H2BrClN2.
The CAS number is 760207-83-8.
The IUPAC name is 3-bromo-5-chloropyridine-2-carbonitrile.
The molecular weight is 217.45 g/mol.
The InChI is InChI=1S/C6H2BrClN2/c7-5-1-4(8)3-10-6(5)2-9/h1,3H.
The canonical SMILES is C1=C(C=NC(=C1Br)C#N)Cl.
The XLogP3-AA value is 2.2.
The hydrogen bond donor count is 0.
The hydrogen bond acceptor count is 2.
The topological polar surface area is 36.7Ų.