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5905-22-6

5905-22-6 structural image
Product Name: disodium 7-[[3-[(4-aminobenzoyl)amino]benzoyl]amino]-4-hydroxy-3-[[4-[(4-sulphonatophenyl)azo]phenyl]azo]naphthalene-2-sulphonate
Formula: C36H25N7Na2O9S2
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COMPUTED DESCRIPTORS

Molecular Weight 809.7 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 14
Rotatable Bond Count 8
Exact Mass 809.09505631 g/mol
Monoisotopic Mass 809.09505631 g/mol
Topological Polar Surface Area 285 Ų
Heavy Atom Count 56
Formal Charge 0
Complexity 1540
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 3
Compound Is Canonicalized Yes