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40506-05-6

40506-05-6 structural image
Product Name: 1,1-DIOXO-2-(2-OXO-PROPYL)-1,2-DIHYDRO-1LAMBDA*6*-BENZO[D]ISOTHIAZOL-3-ONE
Formula: C10H9NO4S
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COMPUTED DESCRIPTORS

Molecular Weight 239.25 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 239.02522894 g/mol
Monoisotopic Mass 239.02522894 g/mol
Topological Polar Surface Area 79.9 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 423
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes