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6441-90-3

6441-90-3 structural image
Product Name: 1,6-Naphthalenedisulfonic acid, 8-hydroxy-7-[[4-[[4'-[(1-hydroxy-3,8-disulfo-2-naphthalenyl)azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-1-naphthalenyl]azo]-, tetrasodium salt
Formula: C44H28N6Na4O14S4
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COMPUTED DESCRIPTORS

Molecular Weight 1085.0 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 20
Rotatable Bond Count 7
Exact Mass 1084.0137114 g/mol
Monoisotopic Mass 1084.0137114 g/mol
Topological Polar Surface Area 377 Ų
Heavy Atom Count 72
Formal Charge 0
Complexity 2270
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 5
Compound Is Canonicalized Yes