Decoquinate

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Properties Simple | Detailed

Formula C24H35NO5
IUPAC Name ethyl 6-decoxy-7-ethoxy-4-oxo-1h-quinoline-3-carboxylate
Molecular Mass 417.538 g·mol−1
Heat of Formation -921.9 ± 16.7 kJ·mol−1
Dipole Moment 6.89 ± 1.08 D
Volume 535.65 Å 3
Surface Area 478.01 Å 2
HOMO Energy -8.78 ± 0.55 eV
LUMO Energy 2.25 ± eV
Point Group Symmetry C1
Synonyms
  • 3-quinolinecarboxylic acid, 6-(decyloxy)-7-ethoxy-4-hydroxy-, ethyl ester
  • 6-decoxy-7-ethoxy-4-keto-1h-quinoline-3-carboxylic acid ethyl ester
  • 6-decoxy-7-ethoxy-4-oxo-1h-quinoline-3-carboxylic acid ethyl ester
  • 6-decyloxy-7-ethoxy-4-hydroxy-3-quinolinecarboxylic acid ethyl ester
  • d03667
  • deccox
  • decoquinate (usp)
  • decoxy
  • ethyl 5-decyloxy-7-ethoxy-4-hydroxy-3-chinolincarboxylat
  • ethyl 6-(decyloxy)-7-ethoxy-4-hydroxy-3-quinolinecarboxylate
  • ethyl 6-decoxy-7-ethoxy-4-oxo-1h-quinoline-3-carboxylate
  • ethyl 6-decyloxy-7-ethoxy-4-hydroxy-3-quinolinate
  • hc 1528
  • m and b 15497
  • m&b 15497
  • m. and b. 15497
CAS Number(s)
  • 18507-89-6
InChIKey JHAYEQICABJSTP-UHFFFAOYSA-N
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