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352534-80-6

352534-80-6 structural image
Product Name: 2,4,5-TRIMETHYLPHENYLBORONIC ACID
Formula: C9H13BO2
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COMPUTED DESCRIPTORS

Molecular Weight 164.01 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 164.1008598 g/mol
Monoisotopic Mass 164.1008598 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 150
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