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79703-02-9

79703-02-9 structural image
Product Name: 6-bromopenicillanic acid S-sulfoxide
Formula: C8H10BrNO4S
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COMPUTED DESCRIPTORS

Molecular Weight 296.14 g/mol
XLogP3 -0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 1
Exact Mass 294.95139 g/mol
Monoisotopic Mass 294.95139 g/mol
Topological Polar Surface Area 93.9 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 383
Isotope Atom Count 0
Defined Atom Stereocenter Count 3
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes