2-Acetyl-4-Nitro-1-Nitrosoanthraquinone
[CAS# 94199-58-3]

Identification

• Name: 2-Acetyl-4-Nitro-1-Nitrosoanthraquinone
• Synonyms: 2-Acetyl-4-Nitro-1-Nitroso-Anthracene-9,10-Dione; 2-Acetyl-4-Nitro-1-Nitroso-9,10-Anthraquinone; 2-Ethanoyl-4-Nitro-1-Nitroso-Anthracene-9,10-Dione
• Molecular Formula: C₁₆H₈N₂O₆
• Molecular Weight: 324.25
• CAS Registry Number: 94199-58-3
• EINECS: 303-432-0
• SMILES: C1=C(C(=C3C(=C1[N+]([O-])=O)C(=O)C2=CC=CC=C2C3=O)N=O)C(=O)C
• InChI: 1S/C16H8N2O6/c1-7(19)10-6-11(18(23)24)12-13(14(10)17-22)16(21)9-5-3-2-4-8(9)15(12)20/h2-6H,1H3
• InChIKey: CSJUKGNLUWPQDW-UHFFFAOYSA-N

Properties

• Density: 1.598g/cm³ (Cal.)
• Boiling point: 597.322°C at 760 mmHg (Cal.)
• Flash point: 315.049°C (Cal.)