EINECS 274-473-9 structure

EINECS 274-473-9

sodium;1-(3-chlorophenyl)-3-methyl-4-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]pyrazol-5-olate;chromium(3+);8-(methoxycarbonylamino)-1-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]naphthalen-2-olate

Also Known As: Chromate(1-), (2-(3-chlorophenyl)-2,4-dihydro-4-((2-(hydroxy-kappaO)-5-(methylsulfonyl)phenyl)azo-kappaN1)-5-methyl-3H-pyrazol-3-onato(2-)-kappaO3)(methyl (7-(hydroxy-kappaO)-8-((2-(hydroxy-kappaO)-5-(methylsulfonyl)phenyl)azo-kappaN1)-1-naphthalenyl)carbamato(2-))-, sodium|Chromate(1-), (2-(3-chlorophenyl)-2,4-dihydro-4-((2-hydroxy-5-(methylsulfonyl)phenyl)azo)-5-methyl-3H-pyrazol-3-onato(2-))(methyl (7-hydroxy-8-((2-hydroxy-5-(methylsulfonyl)phenyl)azo)-1-naphthalenyl)carbamato(2-))-, sodium|Chromate(1-), (2-(3-chlorophenyl)-2,4-dihydro-4-(2-(2-(hydroxy-kappaO)-5-(methylsulfonyl)phenyl)diazenyl-kappaN1)-5-methyl-3H-pyrazol-3-onato(2-)-kappaO3)(methyl N-(7-(hydroxy-kappaO)-8-(2-(2-(hydroxy-kappaO)-5-(methylsulfonyl)phenyl)diazenyl-kappaN1)-1-naphthalenyl)carbamato(2-))-, sodium (1:1)|Chromate(1-), [2-(3-chlorophenyl)-2,4-dihydro-4-[[2-(hydroxy-.kappa.O)-5-(methylsulfonyl)phenyl]azo-.kappa.N1]-5-methyl-3H-pyrazol-3-onato(2-)-.kappa.O3][methyl [7-(hydroxy-.kappa.O)-8-[[2-(hydroxy-.kappa.O)-5-(methylsulfonyl)phenyl]azo-.kappa.N1]-1-naphthalenyl]carbamato(2-)]-, sodium|Chromate(1-), [2-(3-chlorophenyl)-2,4-dihydro-4-[[2-hydroxy-5-(methylsulfonyl)phenyl]azo]-5-methyl-3H-pyrazol-3-onato(2-)][methyl [7-hydroxy-8-[[2-hydroxy-5-(methylsulfonyl)phenyl]azo]-1-naphthalenyl]carbamato(2-)]-, sodium|Chromate(1-), [2-(3-chlorophenyl)-2,4-dihydro-4-[[2-hydroxy-5-(methylsulfonyl)phenyl]azo]-5-methyl-3H-pyrazol-3-onato(2-)][methyl[7-hydroxy-8-[[2-hydroxy-5-(methylsulfonyl)phenyl]azo]-1-naphthalenyl]carbamato(2-)]-, sodium|Chromium(3+) sodium 2-{(E)-[1-(3-chlorophenyl)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-4-id-4-yl]diazenyl}-4-(methanesulfonyl)phenolate 1-{(E)-[5-(methanesulfonyl)-2-oxidophenyl]diazenyl}-8-[(methoxycarbonyl)amino]naphthalen-2-olate (1/1/1/1)|sodium; 2-(3-chlorophenyl)-5-methyl-4-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]pyrazol-3-olate; chromium(3+); 8-(methoxycarbonylamino)-1-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]naphthalen-2-olate

CAS: 70236-40-7
Molecular Formula C36H28ClCrN7NaO10S2
Molecular Weight 892.033 g/mol
LogP 2.78592
Topological Polar Surface Area 283.0 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 15
Rotatable Bonds 9
Exact Mass 892.033
Monoisotopic Mass 892.033
Heavy Atoms 58
Complexity 1350.0

Chemical Identifiers

CAS Number 70236-40-7
SMILES CC1=NN(C(=C1N=NC2=C(C=CC(=C2)S(=O)(=O)C)[O-])[O-])C3=CC(=CC=C3)Cl.COC(=O)NC1=CC=CC2=C1C(=C(C=C2)[O-])N=NC3=C(C=CC(=C3)S(=O)(=O)C)[O-].[Na+].[Cr+3]
InChIKey GEYMHSPZUDQWAA-UHFFFAOYSA-J

Product Overview

EINECS 274-473-9 (CAS 70236-40-7), with molecular formula C36H28ClCrN7NaO10S2 and molecular weight 892.033 g/mol. IUPAC: sodium;1-(3-chlorophenyl)-3-methyl-4-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]pyrazol-5-olate;chromium(3+);8-(methoxycarbonylamino)-1-[(5-methylsulfonyl-2-oxidophenyl)diazenyl]naphthalen-2-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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