DTXSID901022919

disodium;chromium(3+);2-[[3-methyl-1-(2-methyl-4-sulfonatophenyl)-5-oxidopyrazol-4-yl]diazenyl]-4-sulfonatobenzoate;hydroxide

CAS: 10127-05-6

Molecular Formula	`C18H13CrN4Na2O10S2`
Molecular Weight	607.4 g/mol
Topological Polar Surface Area	238.0 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	13
Rotatable Bonds	3
Exact Mass	606.92737
Heavy Atoms	37
Complexity	930.0

Chemical Identifiers

CAS Number	10127-05-6
SMILES	`CC1=C(C=CC(=C1)S(=O)(=O)[O-])N2C(=C(C(=N2)C)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])C(=O)[O-])[O-].[OH-].[Na+].[Na+].[Cr+3]`
InChIKey	`HCVZUAZRMUUOLN-UHFFFAOYSA-I`

📖 Product Overview

DTXSID901022919 (CAS: 10127-05-6) is a chemical compound with molecular formula C18H13CrN4Na2O10S2 and molecular weight 607.4 g/mol. Its IUPAC systematic name is disodium;chromium(3+);2-[[3-methyl-1-(2-methyl-4-sulfonatophenyl)-5-oxidopyrazol-4-yl]diazenyl]-4-sulfonatobenzoate;hydroxide. Topological Polar Surface Area 238.0 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 13 Rotatable Bonds 3 Exact Mass 606.92737 Heavy Atoms 37 Complexity 930.0 InChI Key: HCVZUAZRMUUOLN-UHFFFAOYSA-I. SMILES: CC1=C(C=CC(=C1)S(=O)(=O)[O-])N2C(=C(C(=N2)C)N=NC3=C(C=CC(=C3)S(=O)(=O)[O-])C(=O)[O-])[O-].[OH-].[Na+].[Na+].[Cr+3].

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