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957121-11-8

957121-11-8 structural image
Product Name: 2-(Methylthio)-5-(trifluoromethoxy)phenylboronic acid
Formula: C8H8BF3O3S
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COMPUTED DESCRIPTORS

Molecular Weight 252.02 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 3
Exact Mass 252.0239299 g/mol
Monoisotopic Mass 252.0239299 g/mol
Topological Polar Surface Area 75 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 227
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