6459-98-9
Product Name:
2,7-Naphthalenedisulfonic acid, 5-amino-4-hydroxy-3-[[4'-[[4-hydroxy-2-(phenylamino)phenyl]azo]-3,3'-dimethyl[1,1'-biphenyl]-4-yl]azo]-, disodium salt
Formula:
C36H28N6Na2O8S2
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COMPUTED DESCRIPTORS
Molecular Weight | 782.8 g/mol |
---|---|
Hydrogen Bond Donor Count | 4 |
Hydrogen Bond Acceptor Count | 14 |
Rotatable Bond Count | 7 |
Exact Mass | 782.12054278 g/mol |
Monoisotopic Mass | 782.12054278 g/mol |
Topological Polar Surface Area | 259 Ų |
Heavy Atom Count | 54 |
Formal Charge | 0 |
Complexity | 1440 |
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 | 3 |
Compound Is Canonicalized | Yes |