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2089226-00-4

2089226-00-4 structural image
Product Name: [1,1′-Biphenyl]-3,5-dicarboxylic acid, 4′-borono-, 3,5-diethyl ester
Formula: C18H19BO6
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COMPUTED DESCRIPTORS

Molecular Weight 342.2 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 8
Exact Mass 342.1274685 g/mol
Monoisotopic Mass 342.1274685 g/mol
Topological Polar Surface Area 93.1 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 421
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