Products 20514-27-6

CAS 20514-27-6 appears in our catalog under these names: Santalol mpurity 2, Sodium 4-(3-(Ethoxycarbonyl)-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonate, 1H-Pyrazole-3-carboxylic acid, 4,5-dihydro-5-oxo-1-(4-sulfophenyl)-, 3-ethyl ester, sodium salt (1:1), 95%, 95%. Offered by: Chemat Brand, TRC, Chemat. Available pack sizes: on request, 500mg, 5mg, 25mg, 100mg.

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

Sodium 4-(3-ethoxycarbonyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonate (CAS 20514-27-6) is a chemical compound with the molecular formula C12H11N2NaO6S and a molecular weight of 334.28 g/mol. IUPAC name: sodium 4-(3-ethoxycarbonyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonate. InChIKey: GNXIJSWIFNGBLX-UHFFFAOYSA-M.

Identity
Molecular formulaC12H11N2NaO6S
Molecular weight334.28 g/mol
IUPAC namesodium 4-(3-ethoxycarbonyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonate
InChIKeyGNXIJSWIFNGBLX-UHFFFAOYSA-M
SMILESCCOC(=O)C1=NN(C(=O)C1)C2=CC=C(C=C2)S(=O)(=O)[O-].[Na+]

Computed by PubChem (NCBI)