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850689-37-1

850689-37-1 structural image
Product Name: 2-amino-4-cyanophenylboronicacid
Formula: C7H7BN2O2
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COMPUTED DESCRIPTORS

Molecular Weight 161.96 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 162.0600576 g/mol
Monoisotopic Mass 162.0600576 g/mol
Topological Polar Surface Area 90.3 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 201
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