7-Bromo-8-fluoroquinolin-4-ol

• Catalog: OFC2111860376
• CAS: 2111860-37-6
• Category: Fluorinated Quinolines
• Synonyms: 7-bromo-8-fluoro-1H-quinolin-4-one
• MDL Number: MFCD32200321

• IUPAC Name: 7-bromo-8-fluoro-1H-quinolin-4-one
• InChI: InChI=1S/C9H5BrFNO/c10-6-2-1-5-7(13)3-4-12-9(5)8(6)11/h1-4H,(H,12,13)
• InChI Key: DHGUXOLSIZFBJX-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC(=C(C2=C1C(=O)C=CN2)F)Br

• Molecular Formula: C9H5BrFNO
• Molecular Weight: 242.04

• XLogP3-AA: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• 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