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4404-39-1

4404-39-1 structural image
Product Name: sodium 5-[[4-acetamido-2-[(p-tolyl)sulphonyl]phenyl]azo]-6-amino-4-hydroxynaphthalene-2-sulphonate
Formula: C25H23N4NaO7S2
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COMPUTED DESCRIPTORS

Molecular Weight 576.6 g/mol
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 6
Exact Mass 576.07493565 g/mol
Monoisotopic Mass 576.07493565 g/mol
Topological Polar Surface Area 208 Ų
Heavy Atom Count 39
Formal Charge 0
Complexity 1090
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 2
Compound Is Canonicalized Yes