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71002-20-5

71002-20-5 structural image
Product Name: octasodium 2,2'-[1,4-phenylenebis[imino(6-chloro-1,3,5-triazine-4,2-diyl)imino(1-hydroxy-3,6-disulphonatonaphthalene-2,8-diyl)azo]]bisnaphthalene-1,5-disulphonate
Formula: C52H26Cl2N14Na8O26S8
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COMPUTED DESCRIPTORS

Molecular Weight 1774.2 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 40
Rotatable Bond Count 12
Exact Mass 1771.7466960 g/mol
Monoisotopic Mass 1771.7466960 g/mol
Topological Polar Surface Area 740 Ų
Heavy Atom Count 110
Formal Charge 0
Complexity 3650
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 9
Compound Is Canonicalized Yes