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98541-36-7

98541-36-7 structural image
Product Name: n-Butane-2-boronic acid (1S,2S,3R,5S)-(+)-2,3-pinanediol ester
Formula: C14H25BO2
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COMPUTED DESCRIPTORS

Molecular Weight 236.16 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 236.1947602 g/mol
Monoisotopic Mass 236.1947602 g/mol
Topological Polar Surface Area 18.5 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 330
Isotope Atom Count 0
Defined Atom Stereocenter Count 4
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes