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91101-24-5

91101-24-5 structural image
Product Name: 1-(2-CHLORO-5-SULFOPHENYL)-3-METHYL-4-(4-SULFOPHENYL)AZO-2-PYRAZOLIN-5-ONE DISODIUM SALT
Formula: C16H13ClN4O7S2
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COMPUTED DESCRIPTORS

Molecular Weight 516.8 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 3
Exact Mass 515.9553073 g/mol
Monoisotopic Mass 515.9553073 g/mol
Topological Polar Surface Area 189 Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 907
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 3
Compound Is Canonicalized Yes