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52636-61-0

52636-61-0 structural image
Product Name: 4-[4-[[2-methyl-4-[[(p-tolyl)sulphonyl]oxy]phenyl]azo]anilino]-3-nitrobenzenesulphonic acid
Formula: C26H22N4O8S2
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COMPUTED DESCRIPTORS

Molecular Weight 582.6 g/mol
XLogP3 6.2
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 11
Rotatable Bond Count 8
Exact Mass 582.08790602 g/mol
Monoisotopic Mass 582.08790602 g/mol
Topological Polar Surface Area 197 Ų
Heavy Atom Count 40
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 1
Compound Is Canonicalized Yes

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