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80047-23-0

80047-23-0 structural image
Product Name: 1,2-dimethyl-6-oxo-1,6-dihydro-3,4'-bipyridine-5-carbonitrile
Formula: C13H11N3O
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COMPUTED DESCRIPTORS

Molecular Weight 225.25 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 225.090211983 g/mol
Monoisotopic Mass 225.090211983 g/mol
Topological Polar Surface Area 57 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 447
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes