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871125-81-4

871125-81-4 structural image
Product Name: 3-BROMO-5-ISOPROPOXYPHENYLBORONIC ACID
Formula: C9H12BBrO3
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COMPUTED DESCRIPTORS

Molecular Weight 258.91 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 258.00629 g/mol
Monoisotopic Mass 258.00629 g/mol
Topological Polar Surface Area 49.7 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 1
Compound Is Canonicalized Yes