3-Methyl-4-(3-Methyl-5-Oxo-2-Pyrazolin-1-Yl)Benzenesulfonic Acid Sodium Salt
[CAS# 63589-05-9]

Identification

• Name: 3-Methyl-4-(3-Methyl-5-Oxo-2-Pyrazolin-1-Yl)Benzenesulfonic Acid Sodium Salt
• Synonyms: Sodium 4-(5-Keto-3-Methyl-4H-Pyrazol-1-Yl)-3-Methyl-Benzenesulfonate; Benzenesulfonic Acid, 4-(4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-1-Yl)-3-Methyl-, Sodium Salt
• Molecular Formula: C₁₁H₁₁N₂NaO₄S
• Molecular Weight: 290.27
• CAS Registry Number: 63589-05-9
• SMILES: C1=C(C(=CC=C1[S]([O-])(=O)=O)N2N=C(CC2=O)C)C.[Na+]
• InChI: 1S/C11H12N2O4S.Na/c1-7-5-9(18(15,16)17)3-4-10(7)13-11(14)6-8(2)12-13;/h3-5H,6H2,1-2H3,(H,15,16,17);/q;+1/p-1
• InChIKey: XQLVITJSKICPFO-UHFFFAOYSA-M