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80886-98-2

80886-98-2 structural image
Product Name: Thioperoxydicarbonic diamide ([(H2N)C(S)]2S2), N,N'-bis(6-methyl-2-benzothiazolyl)- (9CI)
Formula: C18H14N4S6
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COMPUTED DESCRIPTORS

Molecular Weight 450.7 g/mol
XLogP3 6
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 5
Exact Mass 449.92297338 g/mol
Monoisotopic Mass 449.92297338 g/mol
Topological Polar Surface Area 221 Ų
Heavy Atom Count 26
Formal Charge 0
Complexity 489
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