4,6-Diphenyl-3-Methylisoxazolo[3,4-d]Pyridazin-7(6H)-One
[CAS# 25506-01-8]

Identification

• Name: 4,6-Diphenyl-3-Methylisoxazolo[3,4-d]Pyridazin-7(6H)-One
• Synonyms: 3-Methyl-4,6-Di(Phenyl)Isoxazolo[3,4-D]Pyridazin-7-One; 3-Methyl-4,6-Di(Phenyl)-7-Isoxazolo[3,4-D]Pyridazinone; 3-Methyl-4,6-Diphenyl-6,7-Dihydroisoxazolo[3,4-D]Pyridazin-7-One
• Molecular Formula: C₁₈H₁₃N₃O₂
• Molecular Weight: 303.32
• CAS Registry Number: 25506-01-8
• SMILES: C1=CC=CC=C1C3=NN(C2=CC=CC=C2)C(C4=NOC(=C34)C)=O
• InChI: 1S/C18H13N3O2/c1-12-15-16(13-8-4-2-5-9-13)19-21(14-10-6-3-7-11-14)18(22)17(15)20-23-12/h2-11H,1H3
• InChIKey: JXQJWJVSXBROGH-UHFFFAOYSA-N

Properties

• Density: 1.311g/cm³ (Cal.)
• Boiling point: 510.315°C at 760 mmHg (Cal.)
• Flash point: 262.43°C (Cal.)