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113411-11-3

113411-11-3 structural image
Product Name: 3-(4-cyano-3-beta-hydroxyethylmercapto-2-oxobutylideneamino)-2-oxazolidone
Formula: C10H13N3O4S
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COMPUTED DESCRIPTORS

Molecular Weight 271.30 g/mol
XLogP3 -0.5
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 7
Exact Mass 271.06267708 g/mol
Monoisotopic Mass 271.06267708 g/mol
Topological Polar Surface Area 128 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 390
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes