6-Bromo-2-(3,5-Dimethyl-1H-Pyrazol-4-Yl)-1H-Benz[de]Isoquinoline-1,3(2H)-Dione
[CAS# 51461-22-4]

Identification

• Name: 6-Bromo-2-(3,5-Dimethyl-1H-Pyrazol-4-Yl)-1H-Benz[de]Isoquinoline-1,3(2H)-Dione
• Synonyms: Zinc00840950; Ak-968/12116352; Oprea1_767110
• Molecular Formula: C₁₇H₁₂BrN₃O₂
• Molecular Weight: 370.20
• CAS Registry Number: 51461-22-4
• EINECS: 257-220-7
• SMILES: C3=C1C(N(C(C2=C1C(=CC=C2)C(=C3)Br)=O)C4=C([NH]N=C4C)C)=O
• InChI: 1S/C17H12BrN3O2/c1-8-15(9(2)20-19-8)21-16(22)11-5-3-4-10-13(18)7-6-12(14(10)11)17(21)23/h3-7H,1-2H3,(H,19,20)
• InChIKey: UKRUVKDTLCRXNL-UHFFFAOYSA-N

Properties

• Density: 1.674g/cm³ (Cal.)
• Boiling point: 621.323°C at 760 mmHg (Cal.)
• Flash point: 329.564°C (Cal.)