5-Bromo-8-fluoroquinolin-2(1H)-one

• Catalog: OFC1341609106
• CAS: 1341609-10-6
• Category: Fluorinated Quinolines
• Synonyms: 5-Bromo-8-fluoroquinolin-2-ol
• Purity: 97%
• MDL Number: MFCD19678325

• IUPAC Name: 5-bromo-8-fluoro-1H-quinolin-2-one
• InChI: InChI=1S/C9H5BrFNO/c10-6-2-3-7(11)9-5(6)1-4-8(13)12-9/h1-4H,(H,12,13)
• InChI Key: KQKSIZGEZCJLMJ-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC(=O)NC2=C(C=CC(=C21)Br)F
• EC Number: 832-493-0

• Molecular Formula: C9H5BrFNO
• Molecular Weight: 242.04
• Storage: Sealed in dry, room temperature

• XLogP3-AA: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 240.95385 g/mol
• Monoisotopic Mass: 240.95385 g/mol
• Topological Polar Surface Area: 29.1Ų
• Heavy Atom Count: 13
• Formal Charge: 0
• Complexity: 256