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79135-87-8

79135-87-8 structural image
Product Name: hexasodium 2,2'-[vinylenebis[(3-sulphonato-4,1-phenylene)imino[6-[(2-cyanoethyl)[2-(2-hydroxyethoxy)ethyl]amino]-1,3,5-triazine-4,2-diyl]imino]]bis[benzene-1,4-disulphonate]
Formula: C46H44N14Na6O22S6
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COMPUTED DESCRIPTORS

Molecular Weight 1475.3 g/mol
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 36
Rotatable Bond Count 26
Exact Mass 1474.0465018 g/mol
Monoisotopic Mass 1474.0465018 g/mol
Topological Polar Surface Area 632 Ų
Heavy Atom Count 94
Formal Charge 0
Complexity 2790
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 7
Compound Is Canonicalized Yes