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90604-82-3

90604-82-3 structural image
Product Name: trisodium 5-[[2-amino-4-[[4-[2-(4-nitro-2-sulphonatophenyl)vinyl]-3-sulphonatophenyl]azoxy]phenyl]azo]naphthalene-1-sulphonate
Formula: C30H19N6Na3O12S3
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COMPUTED DESCRIPTORS

Molecular Weight 820.7 g/mol
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 6
Exact Mass 819.99161643 g/mol
Monoisotopic Mass 819.99161643 g/mol
Topological Polar Surface Area 334 Ų
Heavy Atom Count 54
Formal Charge 0
Complexity 1630
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 4
Compound Is Canonicalized Yes