1-Ethyl-6-Fluoro-7-(4-Methyl-3-Oxo-1-Piperazinyl)-4-Oxo-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C17H18FN3O4
IUPAC Name 1-ethyl-6-fluoro-7-[(1r)-4-methyl-3-oxo-piperazin-1-yl]-4-oxo-5,8-dihydro-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 347.341 g·mol−1
Heat of Formation -702.3 ± 16.7 kJ·mol−1
Dipole Moment 7.77 ± 1.08 D
Volume 386.32 Å 3
Surface Area 339.34 Å 2
HOMO Energy -8.90 ± 0.55 eV
LUMO Energy 2.06 ± eV
Point Group Symmetry C1
Synonyms
  • 1-ethyl-6-fluoro-4-keto-7-(3-keto-4-methyl-piperazin-1-yl)quinoline-3-carboxylic acid
  • 1-ethyl-6-fluoro-7-(4-methyl-3-oxo-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid
  • 1-ethyl-6-fluoro-7-(4-methyl-3-oxo-piperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid
  • 1-ethyl-6-fluoro-7-(4-methyl-3-oxopiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid
  • 3-quinolinecarboxylic acid, 1-ethyl-6-fluoro-1,4-dihydro-7-(4-methyl-3-oxo-1-piperazinyl)-4-oxo-
  • oxoperfloxacin
CAS Number(s)
  • 85145-22-8
InChIKey QWIPAEMIJPNBFY-UHFFFAOYSA-N
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