6-Fluoro-1-(2-Methylphenyl)-4-Oxo-7-Piperazin-1-Ylquinoline-3-Carboxylic Acid
[CAS# 155188-32-2]

Identification

• Name: 6-Fluoro-1-(2-Methylphenyl)-4-Oxo-7-Piperazin-1-Ylquinoline-3-Carboxylic Acid
• Synonyms: 6-Fluoro-1-(2-Methylphenyl)-4-Oxo-7-Piperazin-1-Yl-Quinoline-3-Carboxylic Acid; 6-Fluoro-1-(2-Methylphenyl)-4-Oxo-7-(1-Piperazinyl)-3-Quinolinecarboxylic Acid; 6-Fluoro-4-Keto-1-(2-Methylphenyl)-7-Piperazin-1-Yl-Quinoline-3-Carboxylic Acid
• Molecular Formula: C₂₁H₂₀FN₃O₃
• Molecular Weight: 381.41
• CAS Registry Number: 155188-32-2
• SMILES: C1=CC=CC(=C1C)N2C=C(C(O)=O)C(=O)C3=C2C=C(C(=C3)F)N4CCNCC4
• InChI: 1S/C21H20FN3O3/c1-13-4-2-3-5-17(13)25-12-15(21(27)28)20(26)14-10-16(22)19(11-18(14)25)24-8-6-23-7-9-24/h2-5,10-12,23H,6-9H2,1H3,(H,27,28)
• InChIKey: UNDKSFYVMMPOSB-UHFFFAOYSA-N

Properties

• Density: 1.361g/cm³ (Cal.)
• Boiling point: 612.57°C at 760 mmHg (Cal.)
• Flash point: 324.271°C (Cal.)