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24783-42-4

24783-42-4 structural image
Product Name: 2-(6-CHLORO-2-PYRIDINYL)-2-PHENYLACETONITRILE
Formula: C13H9ClN2
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COMPUTED DESCRIPTORS

Molecular Weight 228.67 g/mol
XLogP3 3.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 228.0454260 g/mol
Monoisotopic Mass 228.0454260 g/mol
Topological Polar Surface Area 36.7 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 264
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes