Sodium 6-[(1,5-Dimethyl-3-Oxo-2-Phenyl-Pyrazol-4-Yl)Iminomethyl]-2,3-Dimethoxy-Benzoate
[CAS# 66913-44-8]

Identification

• Name: Sodium 6-[(1,5-Dimethyl-3-Oxo-2-Phenyl-Pyrazol-4-Yl)Iminomethyl]-2,3-Dimethoxy-Benzoate
• Synonyms: Sodium 6-[(1,5-Dimethyl-3-Oxo-2-Phenyl-Pyrazol-4-Yl)Iminomethyl]-2,3-Dimethoxy-Benzoate; Sodium 6-[(1,5-Dimethyl-3-Oxo-2-Phenyl-4-Pyrazolyl)Iminomethyl]-2,3-Dimethoxybenzoate; Sodium 6-[(3-Keto-1,5-Dimethyl-2-Phenyl-Pyrazol-4-Yl)Iminomethyl]-2,3-Dimethoxy-Benzoate
• Molecular Formula: C₂₁H₂₀N₃NaO₅
• Molecular Weight: 417.40
• CAS Registry Number: 66913-44-8
• SMILES: C1=CC(=C(OC)C(=C1C=NC2=C(N(N(C2=O)C3=CC=CC=C3)C)C)C([O-])=O)OC.[Na+]
• InChI: 1S/C21H21N3O5.Na/c1-13-18(20(25)24(23(13)2)15-8-6-5-7-9-15)22-12-14-10-11-16(28-3)19(29-4)17(14)21(26)27;/h5-12H,1-4H3,(H,26,27);/q;+1/p-1
• InChIKey: QJZZRGFRHCUXPE-UHFFFAOYSA-M

Properties

• Boiling point: 552.9°C at 760 mmHg (Cal.)
• Flash point: 288.2°C (Cal.)