(2Z)-2-(2-Hexyl-6-Oxo-2,4-Cyclohexadien-1-Ylidene)-8-Hydroxy-1,2-Dihydro-4-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C22H23NO4
IUPAC Name (2z)-2-(2-hexyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-8-hydroxy-1h-quinoline-4-carboxylic acid
Molecular Mass 365.422 g·mol−1
Heat of Formation -600.0 ± 16.7 kJ·mol−1
Dipole Moment 1.53 ± 1.08 D
Volume 438.52 Å 3
Surface Area 344.87 Å 2
HOMO Energy -9.05 ± 0.55 eV
LUMO Energy -1.46 ± eV
Point Group Symmetry C1
Synonyms
  • (2z)-2-(2-hexyl-6-keto-1-cyclohexa-2,4-dienylidene)-8-hydroxy-1h-quinoline-4-carboxylic acid
  • (2z)-2-(2-hexyl-6-oxo-1-cyclohexa-2,4-dienylidene)-8-hydroxy-1h-quinoline-4-carboxylic acid
  • 2-(2-hydroxy-5-n-hexylphenyl)-8-quinolinol-4-carboxylic acid
  • 2-(5-hexyl-2-hydroxyphenyl)-8-hydroxy-4-quinolinecarboxylic acid
  • 2-(5-hexyl-2-hyroxyphenyl)-8-hydroxycinchoninic acid
  • 4-quinolinecarboxylic acid, 2-(5-hexyl-2-hydroxyphenyl)-8-hydroxy- (9ci)
  • 4-quinolinecarboxylic acid, 8-hydroxy-2-(2-hydroxy-5-hexylphenyl)-
  • hq-ii
CAS Number(s)
  • 55066-81-4
InChIKey BCZJXFPWVWHYEK-JZJYNLBNSA-N
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