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300376-96-9

300376-96-9 structural image
Product Name: 4-(4-nitrophenyl)sulfonyl-4-phenylbutan-2-one
Formula: C16H15NO5S
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CHEMICAL AND PHYSICAL PROPERTIES

Solubility >50 [ug/mL] (The mean of the results at pH 7.4)

COMPUTED DESCRIPTORS

Molecular Weight 333.4 g/mol
XLogP3 2.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 5
Exact Mass 333.06709375 g/mol
Monoisotopic Mass 333.06709375 g/mol
Topological Polar Surface Area 105 Ų
Heavy Atom Count 23
Formal Charge 0
Complexity 520
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes