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6104-56-9

6104-56-9 structural image
Product Name: trisodium 7-[[4-[[4-[[6-[(4-aminobenzoyl)amino]-1-hydroxy-3-sulphonato-2-naphthyl]azo]benzoyl]amino]-o-tolyl]azo]naphthalene-1,3-disulphonate
Formula: C41H28N7Na3O12S3
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COMPUTED DESCRIPTORS

Molecular Weight 975.9 g/mol
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 17
Rotatable Bond Count 8
Exact Mass 975.06511572 g/mol
Monoisotopic Mass 975.06511572 g/mol
Topological Polar Surface Area 351 Ų
Heavy Atom Count 66
Formal Charge 0
Complexity 1970
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 4
Compound Is Canonicalized Yes