Sodium 5-Phenyl-4,5-Dihydropyrazole-1-Carboxylate
[CAS# 121306-86-3]

Identification

• Name: Sodium 5-Phenyl-4,5-Dihydropyrazole-1-Carboxylate
• Synonyms: 1H-Pyrazole-1-Carboxylic Acid, 4,5-Dihydro-5-Phenyl-, Sodium Salt; Sodium 4,5-Dihydro-5-Phenyl-1H-Pyrazole-1-Carboxylate; Sodium 5-Phenyl-2-Pyrazoline-1-Carboxylate
• Molecular Formula: C₁₀H₉N₂NaO₂
• Molecular Weight: 212.18
• CAS Registry Number: 121306-86-3
• SMILES: C2=C(C1N(N=CC1)C([O-])=O)C=CC=C2.[Na+]
• InChI: 1S/C10H10N2O2.Na/c13-10(14)12-9(6-7-11-12)8-4-2-1-3-5-8;/h1-5,7,9H,6H2,(H,13,14);/q;+1/p-1
• InChIKey: KFTLNIRJGYOQRK-UHFFFAOYSA-M

Properties

• Boiling point: 367.8°C at 760 mmHg (Cal.)
• Flash point: 176.2°C (Cal.)