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12225-77-3

12225-77-3 structural image
Product Name: C.I. Reactive green 8
Formula: C40H23ClN11Na5O18S5
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COMPUTED DESCRIPTORS

Molecular Weight 1256.4 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 27
Rotatable Bond Count 9
Exact Mass 1254.9003079 g/mol
Monoisotopic Mass 1254.9003079 g/mol
Topological Polar Surface Area 543 Ų
Heavy Atom Count 80
Formal Charge 0
Complexity 2690
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 6
Compound Is Canonicalized Yes