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94233-04-2

94233-04-2 structural image
Product Name: BASIC BLUE 66
Formula: C22H28Cl3N5O2SZn
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COMPUTED DESCRIPTORS

Molecular Weight 598.3 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 10
Exact Mass 595.032071 g/mol
Monoisotopic Mass 595.032071 g/mol
Topological Polar Surface Area 112 Ų
Heavy Atom Count 34
Formal Charge 0
Complexity 574
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 2
Compound Is Canonicalized Yes