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24139-57-9

24139-57-9 structural image
Product Name: ALPHA-CYANO-5-PHENYL-2,4-PENTADIENIC ACID
Formula: C12H9NO2
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COMPUTED DESCRIPTORS

Molecular Weight 199.20 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 199.063328530 g/mol
Monoisotopic Mass 199.063328530 g/mol
Topological Polar Surface Area 61.1 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 327
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes