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898779-84-5

898779-84-5 structural image
Product Name: 2-(3-CYANOBENZOYL)PYRIDINE
Formula: C13H8N2O
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COMPUTED DESCRIPTORS

Molecular Weight 208.21 g/mol
XLogP3 1.6
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 208.063662883 g/mol
Monoisotopic Mass 208.063662883 g/mol
Topological Polar Surface Area 53.8 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 304
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