Products 65212-77-3

CAS 65212-77-3 appears in our catalog under these names: Pigment Yellow 183, Benzenesulfonic acid, 4,5-dichloro-2-[2-[4,5-dihydro-3-methyl-5-oxo-1-(3-sulfophenyl)-1H-pyrazol-4-yl]diazenyl]-, calcium salt (1:1). Offered by: MedChemExpress, Chemat. Available pack sizes: Get quote, 1g, 5g, 25g.

Structural formula: {0} (CAS {1})

Calcium 4,5-dichloro-2-[[3-methyl-5-oxo-1-(3-sulfonatophenyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonate (CAS 65212-77-3) is a chemical compound with the molecular formula C16H10CaCl2N4O7S2 and a molecular weight of 545.4 g/mol. IUPAC name: calcium 4,5-dichloro-2-[[3-methyl-5-oxo-1-(3-sulfonatophenyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonate. InChIKey: KJAXOZTWNHRZQG-UHFFFAOYSA-L.

Identity
Molecular formulaC16H10CaCl2N4O7S2
Molecular weight545.4 g/mol
IUPAC namecalcium 4,5-dichloro-2-[[3-methyl-5-oxo-1-(3-sulfonatophenyl)-4H-pyrazol-4-yl]diazenyl]benzenesulfonate
InChIKeyKJAXOZTWNHRZQG-UHFFFAOYSA-L
SMILESCC1=NN(C(=O)C1N=NC2=CC(=C(C=C2S(=O)(=O)[O-])Cl)Cl)C3=CC(=CC=C3)S(=O)(=O)[O-].[Ca+2]

Computed by PubChem (NCBI)