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677702-23-7

677702-23-7 structural image
Product Name: ISOQUINOLINE-4-BORONIC ACID HYDROCHLORIDE
Formula: C9H9BClNO2
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COMPUTED DESCRIPTORS

Molecular Weight 209.44 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 209.0414864 g/mol
Monoisotopic Mass 209.0414864 g/mol
Topological Polar Surface Area 53.4 Ų
Heavy Atom Count 14
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 2
Compound Is Canonicalized Yes