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884001-09-6

884001-09-6 structural image
Product Name: Benzoic acid, 3-(1-cyanocyclobutyl)-
Formula: C12H11NO2
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COMPUTED DESCRIPTORS

Molecular Weight 201.22 g/mol
XLogP3 2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 2
Exact Mass 201.078978594 g/mol
Monoisotopic Mass 201.078978594 g/mol
Topological Polar Surface Area 61.1 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 311
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