6-Fluoro-4-Oxo-1-[(1R,2S)-2-Phenylcyclopropyl]-7-Piperazin-1-Ylquinoline-3-Carboxylic Acid
[CAS# 103531-48-2]

Identification

• Name: 6-Fluoro-4-Oxo-1-[(1R,2S)-2-Phenylcyclopropyl]-7-Piperazin-1-Ylquinoline-3-Carboxylic Acid
• Synonyms: 6-Fluoro-4-Oxo-1-[(1R,2S)-2-Phenylcyclopropyl]-7-Piperazin-1-Yl-Quinoline-3-Carboxylic Acid; 6-Fluoro-4-Oxo-1-[(1R,2S)-2-Phenylcyclopropyl]-7-(1-Piperazinyl)-3-Quinolinecarboxylic Acid; 6-Fluoro-4-Keto-1-[(1R,2S)-2-Phenylcyclopropyl]-7-Piperazin-1-Yl-Quinoline-3-Carboxylic Acid
• Molecular Formula: C₂₃H₂₂FN₃O₃
• Molecular Weight: 407.44
• CAS Registry Number: 103531-48-2
• SMILES: [C@H]4(N1C2=C(C(=O)C(=C1)C(=O)O)C=C(F)C(=C2)N3CCNCC3)[C@@H](C4)C5=CC=CC=C5
• InChI: 1S/C23H22FN3O3/c24-18-10-16-20(12-21(18)26-8-6-25-7-9-26)27(13-17(22(16)28)23(29)30)19-11-15(19)14-4-2-1-3-5-14/h1-5,10,12-13,15,19,25H,6-9,11H2,(H,29,30)/t15-,19+/m0/s1
• InChIKey: FNNPFNDZIMUNOD-HNAYVOBHSA-N

Properties

• Density: 1.4g/cm³ (Cal.)
• Boiling point: 653.588°C at 760 mmHg (Cal.)
• Flash point: 349.078°C (Cal.)