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3343-66-6

3343-66-6 structural image
Product Name: S-(4-bromophenyl)mercapturic acid
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COMPUTED DESCRIPTORS

Molecular Weight 318.19 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 5
Exact Mass 316.97213 g/mol
Monoisotopic Mass 316.97213 g/mol
Topological Polar Surface Area 91.7 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 280
Isotope Atom Count 0
Defined Atom Stereocenter Count 1
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

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