6-Nitro-3-Phenyl-2H-1,3-Benzoxazin-4(3H)-One
[CAS# 20979-01-5]

Identification

• Name: 6-Nitro-3-Phenyl-2H-1,3-Benzoxazin-4(3H)-One
• Synonyms: 2,3-Dihydro-6-Nitro-3-Phenyl-4H-1,3-Benzoxazin-4-One; 4H-1,3-Benzoxazin-4-One, 2,3-Dihydro-6-Nitro-3-Phenyl-; Brn 1590486
• Molecular Formula: C₁₄H₁₀N₂O₄
• Molecular Weight: 270.24
• CAS Registry Number: 20979-01-5
• SMILES: C1=C([N+]([O-])=O)C=CC3=C1C(=O)N(C2=CC=CC=C2)CO3
• InChI: 1S/C14H10N2O4/c17-14-12-8-11(16(18)19)6-7-13(12)20-9-15(14)10-4-2-1-3-5-10/h1-8H,9H2
• InChIKey: ASXQIAOKRHJTKP-UHFFFAOYSA-N

Properties

• Density: 1.416g/cm³ (Cal.)
• Boiling point: 486.244°C at 760 mmHg (Cal.)
• Flash point: 247.872°C (Cal.)