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958451-79-1

958451-79-1 structural image
Product Name: 4-difluoromethoxy-3-trifluoromethyl-benzeneboronic acid
Formula: C8H6BF5O3
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COMPUTED DESCRIPTORS

Molecular Weight 255.94 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 3
Exact Mass 256.0330150 g/mol
Monoisotopic Mass 256.0330150 g/mol
Topological Polar Surface Area 49.7 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 248
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