1-Ethyl-6-Fluoro-4-Oxo-7-(1-Piperazinyl)-1,4-Dihydro-3-Quinolinecarbaldehyde

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Properties Simple | Detailed

Formula C16H18FN3O2
IUPAC Name 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-5,8-dihydro-2h-quinoline-2,3,4a,5,6,7,8,8a-octaide-3-carbaldehyde
Molecular Mass 303.331 g·mol−1
Heat of Formation -256.7 ± 16.7 kJ·mol−1
Dipole Moment 10.55 ± 1.08 D
Volume 351.85 Å 3
Surface Area 309.99 Å 2
HOMO Energy -8.74 ± 0.55 eV
LUMO Energy 2.16 ± eV
Point Group Symmetry C1
Synonyms
  • 1-effopq
  • 1-ethyl-6-fluoro-3-formyl-1,4-dihydro-4-oxo-7-piperazinylquinoline
  • 1-ethyl-6-fluoro-4-keto-7-piperazin-1-yl-quinoline-3-carbaldehyde
  • 1-ethyl-6-fluoro-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxaldehyde
  • 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-yl-quinoline-3-carbaldehyde
  • 1-ethyl-6-fluoro-4-oxo-7-piperazin-1-ylquinoline-3-carbaldehyde
CAS Number(s)
  • 110719-56-7
InChIKey WZGKLDAQBCEGIR-UHFFFAOYSA-N
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