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6826-53-5

6826-53-5 structural image
Product Name: disodium 3-[[5-chloro-2-(phenylmethoxy)phenyl]azo]-4-hydroxy-5-[[(p-tolyl)sulphonyl]amino]naphthalene-2,7-disulphonate
Formula: C30H22ClN3Na2O10S3
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COMPUTED DESCRIPTORS

Molecular Weight 762.1 g/mol
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 13
Rotatable Bond Count 8
Exact Mass 760.9951237 g/mol
Monoisotopic Mass 760.9951237 g/mol
Topological Polar Surface Area 240 Ų
Heavy Atom Count 49
Formal Charge 0
Complexity 1370
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