RefChem:576220 structure

RefChem:576220

chromium(3+);hydron;3-methyl-4-[(2-oxido-5-sulfamoylphenyl)diazenyl]-1-phenylpyrazol-5-olate;1-[(2-oxido-5-sulfamoylphenyl)diazenyl]naphthalen-2-olate

Also Known As: Chromate(1-), (3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-4-hydroxybenzenesulfonamidato(2-))(4-(hydroxy-kappaO)-3-((2-(hydroxy-kappaO)-1-naphthalenyl)azo-kappaN1)benzenesulfonamidato(2-))-, hydrogen|Chromate(1-), (2,4-dihydro-4-((2-hydroxy-5-(aminosulfonyl)phenyl)azo)-5-methyl-2-phenyl-3H-pyrazol-3-onato(2-))(1-(2-hydroxy-5-(aminosulfonyl)phenyl)azo-2-naphthalenolato)-, hydrogen|Chromate(1-), (3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-4-hydroxybenzenesulfonamidato(2-))(4-(hydroxy-kappaO)-3-(2-(2-(hydroxy-kappaO)-1-naphthalenyl)diazenyl-kappaN1)benzenesulfonamidato(2-))-, hydrogen (1:1)|Chromate(1-), [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxybenzenesulfonamidato(2-)][4-hydroxy-3-[(2-hydroxy-1-naphthalenyl)azo]benzenesulfonamidato(2-)]-, hydrogen|Chromate(1-), [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxybenzensulfonamidato(2-)][4-hydroxy-3-[(2-hydroxy-1-naphthalenyl)azo]benzenesulfonamidato(2-)]-, hydrogen|Chromate(1-), [3-[[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]azo-.kappa.N1]-4-hydroxybenzenesulfonamidato(2-)][4-(hydroxy-.kappa.O)-3-[[2-(hydroxy-.kappa.O)-1-naphthalenyl]azo-.kappa.N1]benzenesulfonamidato(2-)]-, hydrogen|Chromate(1-), [3-[2-[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]diazenyl-.kappa.N1]-4-hydroxybenzenesulfonamidato(2-)][4-(hydroxy-.kappa.O)-3-[2-[2-(hydroxy-.kappa.O)-1-naphthalenyl]diazenyl-.kappa.N1]benzenesulfonamidato(2-)]-, hydrogen (1:1)|Chromate(1-), [3-[2-[4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl]diazenyl-kappaN1]-4-hydroxybenzenesulfonamidato(2-)][4-(hydroxy-kappaO)-3-[2-[2-(hydroxy-kappaO)-1-naphthalenyl]diazenyl-kappaN1]benzenesulfonamidato(2-)]-, hydrogen (1:1)|chromium(3+); hydron; 5-methyl-4-[(2-oxido-5-sulfamoylphenyl)diazenyl]-2-phenylpyrazol-3-olate; 1-[(2-oxido-5-sulfamoylphenyl)diazenyl]naphthalen-2-olate|Hydrogen (3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4-hydroxybenzenesulphonamidato(2-))(4-hydroxy-3-((2-hydroxy-1-naphthyl)azo)benzenesulphonamidato(2-))chromate(1-)|Hydrogen [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxybenzenesulphonamidato(2-)][4-hydroxy-3-[(2-hydroxy-1-naphthyl)azo]benzenesulphonamidato(2-)]chromate(1-)

CAS: 52256-40-3
Molecular Formula C32H25CrN8O8S2
Molecular Weight 765.0642 g/mol
LogP 3.55052
Topological Polar Surface Area 297.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 15
Rotatable Bonds 7
Exact Mass 765.0642
Monoisotopic Mass 765.0642
Heavy Atoms 51
Complexity 1170.0

Chemical Identifiers

CAS Number 52256-40-3
SMILES [H+].CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)N)[O-])[O-])C3=CC=CC=C3.C1=CC=C2C(=C1)C=CC(=C2N=NC3=C(C=CC(=C3)S(=O)(=O)N)[O-])[O-].[Cr+3]
InChIKey XQHUJEIDYTZMPP-UHFFFAOYSA-K

Product Overview

RefChem:576220 (CAS 52256-40-3), with molecular formula C32H25CrN8O8S2 and molecular weight 765.0642 g/mol. IUPAC: chromium(3+);hydron;3-methyl-4-[(2-oxido-5-sulfamoylphenyl)diazenyl]-1-phenylpyrazol-5-olate;1-[(2-oxido-5-sulfamoylphenyl)diazenyl]naphthalen-2-olate.

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