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Homecas769972-01-2

769972-01-2

769972-01-2 structural image
Product Name: 3-(3-Cyanopyridin-2-yl)benzaldehyde
Formula: C13H8N2O
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COMPUTED DESCRIPTORS

Molecular Weight 208.21 g/mol
XLogP3 1.7
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 294
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