6-Ethyl-2,3,6,9-Tetrahydro-3-Methyl-2,9-Dioxothiazolo[5,4-F]Quinoline-8-Carboxylic Acid

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Properties Simple | Detailed

Formula C14H12N2O4S
IUPAC Name 6-ethyl-3-methyl-2,9-dioxo-5,7-dihydro-4h-thiazolo[5,4-f]quinoline-3a,4,5,5a,7,8,9a,9b-octaide-8-carboxylic acid
Molecular Mass 304.321 g·mol−1
Heat of Formation -520.6 ± 16.7 kJ·mol−1
Dipole Moment 9.96 ± 1.08 D
Volume 324.58 Å 3
Surface Area 290.79 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy 1.87 ± eV
Point Group Symmetry C1
Synonyms
  • 6-ethyl-2,3,6,9-tetrahydro-3-methyl-2,9-dioxothiazolo(5,4-f)quinoline-8-carboxylic acid
  • 6-ethyl-2,9-diketo-3-methyl-pyrido[6,5-g][1,3]benzothiazole-8-carboxylic acid
  • 6-ethyl-3-methyl-2,9-dioxo-8-pyrido[6,5-g][1,3]benzothiazolecarboxylic acid
  • 6-ethyl-3-methyl-2,9-dioxo-pyrido[6,5-g][1,3]benzothiazole-8-carboxylic acid
  • 6-ethyl-3-methyl-2,9-dioxopyrido[6,5-g][1,3]benzothiazole-8-carboxylic acid
  • d02468
  • tioxacin
  • tioxic acid
CAS Number(s)
  • 34976-39-1
InChIKey VUUPJGYIOAVFAN-UHFFFAOYSA-N
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