RefChem:576466 structure

RefChem:576466

disodium;chromium(3+);3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate;3-methyl-4-[[2-oxido-5-(phenylsulfamoyl)phenyl]diazenyl]-1-phenylpyrazol-5-olate

Also Known As: O3-de-(N-acetyl-N-methyl-L-alanyl)-maytansine|Chromate(2-), (3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-2-hydroxy-5-nitrobenzenesulfonato(3-))(3-((4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo)-4-hydroxy-N-phenylbenzenesulfonamidato(2-))-, disodium|Chromate(2-), (3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-4-(hydroxy-kappaO)-N-phenylbenzenesulfonamidato(2-))-, disodium|Chromate(2-), (3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(3-(2-(4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)diazenyl-kappaN1)-4-(hydroxy-kappaO)-N-phenylbenzenesulfonamidato(2-))-, sodium (1:2)|Chromate(2-), [3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-2-hydroxy-5-nitrobenzenesulfonato(3-)][3-[(4,5-dihydro-3-methyl-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxy-N-phenylbenzenesulfonamidato(2-)]-, disodium|Chromate(2-), [3-[[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]azo-.kappa.N1]-2-(hydroxy-.kappa.O)-5-nitrobenzenesulfonato(3-)][3-[[4,5-dihydro-3-methyl-5-(oxo-.kappa.O)-1-phenyl-1H-pyrazol-4-yl]azo-.kappa.N1]-4-(hydroxy-.kappa.O)-N-phenylbenzenesulfonamidato(2-)]-, disodium|chromium(3+) sodium 3-[(e)-(3-methyl-5-oxido-1-phenyl-1h-pyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate 3-methyl-4-{(e)-[2-oxido-5-(phenylsulfamoyl)phenyl]diazenyl}-1-phenyl-1h-pyrazol-5-olate(1:2:1:1)|260-564-0|Chromate(2-), (3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-2-(hydroxy-kappaO)-5-nitrobenzenesulfonato(3-))(3-((4,5-dihydro-3-methyl-5-(oxo-kappaO)-1-phenyl-1H-pyrazol-4-yl)azo-kappaN1)-4-(hydroxy-kappaO)-N-phenylbenzenesu|Chromate(2-), [3-[(4,5-dihydro-3-methyl- 5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-2-hydroxy-5-nitrobenzenesulfonato (3-)][3-[(4,5-dihydro-3-methy l-5-oxo-1-phenyl-1H-pyrazol-4-yl)azo]-4-hydroxy-N-phenylbenzenesulfonamid ato(2-)]-, disodium|Chromium(3+) sodium 3-[(E)-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-id-4-yl)diazenyl]-5-nitro-2-oxidobenzene-1-sulfonate 2-[(E)-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-id-4-yl)diazenyl]-4-(phenylsulfamoyl)phenolate (1/2/1/1)|disodium,chromium(3+),3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate,5-methyl-4-[[2-oxido-5-(phenylsulfamoyl)phenyl]diazenyl]-2-phenylpyrazol-3-olate|disodium; chromium(3+); 3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate; 5-methyl-4-[[2-oxido-5-(phenylsulfamoyl)phenyl]diazenyl]-2-phenylpyrazol-3-olate

CAS: 5877-56-5
Molecular Formula C38H27CrN10Na2O11S2
Molecular Weight 961.05023 g/mol
LogP -0.89476
Topological Polar Surface Area 343.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 18
Rotatable Bonds 9
Exact Mass 961.05023
Monoisotopic Mass 961.05023
Heavy Atoms 64
Complexity 1440.0

Chemical Identifiers

CAS Number 5877-56-5
SMILES CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)NC3=CC=CC=C3)[O-])[O-])C4=CC=CC=C4.CC1=NN(C(=C1N=NC2=C(C(=CC(=C2)[N+](=O)[O-])S(=O)(=O)[O-])[O-])[O-])C3=CC=CC=C3.[Na+].[Na+].[Cr+3]
InChIKey WNVYPIUEPPVYFD-UHFFFAOYSA-I

Product Overview

RefChem:576466 (CAS 5877-56-5), with molecular formula C38H27CrN10Na2O11S2 and molecular weight 961.05023 g/mol. IUPAC: disodium;chromium(3+);3-[(3-methyl-5-oxido-1-phenylpyrazol-4-yl)diazenyl]-5-nitro-2-oxidobenzenesulfonate;3-methyl-4-[[2-oxido-5-(phenylsulfamoyl)phenyl]diazenyl]-1-phenylpyrazol-5-olate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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