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40061-29-8

40061-29-8 structural image
Product Name: 1-(PYRIDIN-3-YL)-2-O-TOLYLETHANE-1,2-DIONE
Formula: C14H11NO2
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COMPUTED DESCRIPTORS

Molecular Weight 225.24 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 225.078978594 g/mol
Monoisotopic Mass 225.078978594 g/mol
Topological Polar Surface Area 47 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 301
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