1-Cyclopropyl-7-[(1S)-3,6-Diazabicyclo[2.2.1]Heptan-6-Yl]-6-Fluoro-4-Oxoquinoline-3-Carboxylic Acid
[CAS# 108461-04-7]

Identification

• Name: 1-Cyclopropyl-7-[(1S)-3,6-Diazabicyclo[2.2.1]Heptan-6-Yl]-6-Fluoro-4-Oxoquinoline-3-Carboxylic Acid
• Synonyms: 1-Cyclopropyl-7-[(1S)-3,6-Diazabicyclo[2.2.1]Heptan-6-Yl]-6-Fluoro-4-Oxo-Quinoline-3-Carboxylic Acid; 1-Cyclopropyl-7-[(1S)-3,6-Diazabicyclo[2.2.1]Heptan-6-Yl]-6-Fluoro-4-Oxo-3-Quinolinecarboxylic Acid; 1-Cyclopropyl-7-[(1S)-3,6-Diazabicyclo[2.2.1]Heptan-6-Yl]-6-Fluoro-4-Keto-Quinoline-3-Carboxylic Acid
• Molecular Formula: C₁₈H₁₈FN₃O₃
• Molecular Weight: 343.36
• CAS Registry Number: 108461-04-7
• SMILES: [C@@H]45N(C3=CC1=C(C(=O)C(=CN1C2CC2)C(=O)O)C=C3F)CC(NC4)C5
• InChI: 1S/C18H18FN3O3/c19-14-4-12-15(5-16(14)21-7-9-3-11(21)6-20-9)22(10-1-2-10)8-13(17(12)23)18(24)25/h4-5,8-11,20H,1-3,6-7H2,(H,24,25)/t9?,11-/m0/s1
• InChIKey: LHZDPJRHQVYKPA-UMJHXOGRSA-N

Properties

• Density: 1.523g/cm³ (Cal.)
• Boiling point: 599.01°C at 760 mmHg (Cal.)
• Flash point: 316.07°C (Cal.)