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111574-85-7

111574-85-7 structural image
Product Name: S-(1,2,2-trichlorovinyl)glutathione
Formula: C12H16Cl3N3O6S
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COMPUTED DESCRIPTORS

Molecular Weight 436.7 g/mol
XLogP3 -1.7
Hydrogen Bond Donor Count 5
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 11
Exact Mass 434.982539 g/mol
Monoisotopic Mass 434.982539 g/mol
Topological Polar Surface Area 184 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 556
Isotope Atom Count 0
Defined Atom Stereocenter Count 2
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes