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874290-89-8

874290-89-8 structural image
Product Name: 3-CYANOPYRIDIN-4-YLBORONIC ACID
Formula: C6H5BN2O2
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COMPUTED DESCRIPTORS

Molecular Weight 147.93 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 1
Exact Mass 148.0444076 g/mol
Monoisotopic Mass 148.0444076 g/mol
Topological Polar Surface Area 77.1 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 177
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