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70236-62-3

70236-62-3 structural image
Product Name: disodium [3-[4,5-dihydro-4-[(2-hydroxy-5-nitrophenyl)azo]-3-methyl-5-oxo-1H-pyrazol-1-yl]benzenesulphonato(3-)][1-[[2-hydroxy-5-(phenylazo)phenyl]azo]-2-naphtholato(2-)]chromate(2-)
Formula: C38H24CrN9NaO9S-
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COMPUTED DESCRIPTORS

Molecular Weight 880.7 g/mol
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 3
Exact Mass 880.061813 g/mol
Monoisotopic Mass 880.061813 g/mol
Topological Polar Surface Area 276 Ų
Heavy Atom Count 60
Formal Charge 0
Complexity 1610
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 5
Compound Is Canonicalized Yes