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338954-89-5

338954-89-5 structural image
Product Name: 1-ALLYL-5-(3-CHLOROPHENYL)-2-OXO-1,2-DIHYDRO-3-PYRIDINECARBONITRILE
Formula: C15H11ClN2O
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COMPUTED DESCRIPTORS

Molecular Weight 270.71 g/mol
XLogP3 2.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 3
Exact Mass 270.0559907 g/mol
Monoisotopic Mass 270.0559907 g/mol
Topological Polar Surface Area 44.1 Ų
Heavy Atom Count 19
Formal Charge 0
Complexity 498
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