1-Cyclopropyl-8-ethoxy-6,7-difluoro-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

• Catalog: OFC143158558
• CAS: 143158-55-8
• Category: Fluorinated Quinolines
• Synonyms: 1-Cyclopropyl-8-ethoxy-6,7-difluoro-4-oxoquinoline-3-carboxylic acid
• Purity: 97%
• MDL Number: MFCD30179351

• IUPAC Name: 1-cyclopropyl-8-ethoxy-6,7-difluoro-4-oxoquinoline-3-carboxylic acid
• InChI: InChI=1S/C15H13F2NO4/c1-2-22-14-11(17)10(16)5-8-12(14)18(7-3-4-7)6-9(13(8)19)15(20)21/h5-7H,2-4H2,1H3,(H,20,21)
• InChI Key: OPQCGNDAHQOQPC-UHFFFAOYSA-N
• Isomeric SMILES: CCOC1=C2C(=CC(=C1F)F)C(=O)C(=CN2C3CC3)C(=O)O

• Molecular Formula: C15H13F2NO4
• Molecular Weight: 309.26
• Storage: Sealed in dry, 2-8 °C

• XLogP3-AA: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 309.08126422 g/mol
• Monoisotopic Mass: 309.08126422 g/mol
• Topological Polar Surface Area: 66.8Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 520