1-Cyclopropyl-6-Fluoro-4-Oxo-7-(1H-Pyrrol-1-Yl)-1,4-Dihydro-3-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C17H13FN2O3
IUPAC Name 1-cyclopropyl-6-fluoro-4-oxo-7-pyrrol-1-yl-quinoline-3-carboxylic acid
Molecular Mass 312.295 g·mol−1
Heat of Formation -298.2 ± 16.7 kJ·mol−1
Dipole Moment 6.00 ± 1.08 D
Volume 346.12 Å 3
Surface Area 309.47 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy 1.69 ± eV
Point Group Symmetry C1
Synonyms
  • 1-cyclopropyl-6-fluoro-4-keto-7-pyrrol-1-yl-quinoline-3-carboxylic acid
  • 1-cyclopropyl-6-fluoro-4-oxo-7-(1-pyrrolyl)-3-quinolinecarboxylic acid
  • 1-cyclopropyl-6-fluoro-4-oxo-7-pyrrol-1-yl-quinoline-3-carboxylic acid
  • 1-cyclopropyl-6-fluoro-4-oxo-7-pyrrol-1-ylquinoline-3-carboxylic acid
  • 3-quinolinecarboxylic acid, 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1h-pyrrol-1-yl)-
  • 6-fluoro-1-cyclopropyl-1,4-dihydro-4-oxo-7-(pyrrol-1-yl)quinoline-3-carboxylic acid
  • e 3846
  • e-3846
CAS Number(s)
  • 106891-93-4
InChIKey ISJRMOARTUIEPA-UHFFFAOYSA-N
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