Nitraquazone
[CAS# 56739-21-0]

Identification

• Name: Nitraquazone
• Synonyms: 3-Ethyl-1-(3-Nitrophenyl)Quinazoline-2,4-Quinone; 3-Ethyl-1-(M-Nitrophenyl)-2,4(1H,3H)-Quinazolinedione; Nitraquazona [Spanish]
• Molecular Formula: C₁₆H₁₃N₃O₄
• Molecular Weight: 311.30
• CAS Registry Number: 56739-21-0
• SMILES: C1=CC=CC3=C1N(C2=CC(=CC=C2)[N+](=O)[O-])C(N(CC)C3=O)=O
• InChI: 1S/C16H13N3O4/c1-2-17-15(20)13-8-3-4-9-14(13)18(16(17)21)11-6-5-7-12(10-11)19(22)23/h3-10H,2H2,1H3
• InChIKey: GNWCRBFQZDJFTI-UHFFFAOYSA-N

Properties

• Density: 1.384g/cm³ (Cal.)
• Boiling point: 494.005°C at 760 mmHg (Cal.)
• Flash point: 252.566°C (Cal.)