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39065-51-5

39065-51-5 structural image
Product Name: 4-phenylnicotinonitrile
Formula: C12H8N2
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COMPUTED DESCRIPTORS

Molecular Weight 180.20 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 180.068748264 g/mol
Monoisotopic Mass 180.068748264 g/mol
Topological Polar Surface Area 36.7 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 222
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