3-Nitro-5,6-Diphenyl-1H-Pyrazin-2-One
[CAS# 25468-58-0]

Identification

• Name: 3-Nitro-5,6-Diphenyl-1H-Pyrazin-2-One
• Synonyms: Nciopen2_003163; Nsc64319; Zinc00226143
• Molecular Formula: C₁₆H₁₁N₃O₃
• Molecular Weight: 293.28
• CAS Registry Number: 25468-58-0
• SMILES: C1=C(C=CC=C1)C2=C(N=C([N+]([O-])=O)C(=O)N2)C3=CC=CC=C3
• InChI: 1S/C16H11N3O3/c20-16-15(19(21)22)17-13(11-7-3-1-4-8-11)14(18-16)12-9-5-2-6-10-12/h1-10H,(H,18,20)
• InChIKey: HEKFXRGJKVCEPL-UHFFFAOYSA-N

Properties

• Density: 1.353g/cm³ (Cal.)
• Boiling point: 515.3°C at 760 mmHg (Cal.)
• Flash point: 265.4°C (Cal.)