6,8-Difluoro-1-(2-Fluoroethyl)-4-Oxo-7-(1-Piperazinyl)-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C16H25F3N3O3+
IUPAC Name 6,8-difluoro-1-(2-fluoroethyl)-4-oxo-7-piperazin-1-yl-2,5-dihydroquinoline-2,3,4a,5,6,7,8,8a-octaide-3-carboxylic acid
Molecular Mass 364.383 g·mol−1
Heat of Formation -835.1 ± 16.7 kJ·mol−1
Dipole Moment 7.70 ± 1.08 D
Volume 378.99 Å 3
Surface Area 327.71 Å 2
HOMO Energy -9.11 ± 0.55 eV
LUMO Energy -1.18 ± eV
Point Group Symmetry C1
Synonyms
  • 3-quinolinecarboxylic acid, 6,8-difluoro-1-(2-fluoroethyl)-1,4-dihydro-4-oxo-7-(1-piperazinyl)-
  • 6,8-difluoro-1-(2-fluoroethyl)-4-keto-7-piperazin-1-yl-quinoline-3-carboxylic acid
  • 6,8-difluoro-1-(2-fluoroethyl)-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid
  • 6,8-difluoro-1-(2-fluoroethyl)-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylic acid
  • n-demethylfleroxacin
  • ro 19-7513
  • ro-19-7513
CAS Number(s)
  • 79660-71-2
InChIKey HFMBQTZRNSPHRY-UHFFFAOYSA-N
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