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29822-79-5

29822-79-5 structural image
Product Name: 4-(2-PHENYLETH-1-YNYL)BENZONITRILE
Formula: C15H9N
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COMPUTED DESCRIPTORS

Molecular Weight 203.24 g/mol
XLogP3 4.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 203.073499291 g/mol
Monoisotopic Mass 203.073499291 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 320
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