(2S)-4-Oxo-1,2,3,4-Tetrahydro-2-Quinolinecarboxylic Acid

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Properties Simple | Detailed

Formula C10H9NO3
IUPAC Name (2s)-4-oxo-2,3-dihydro-1h-quinoline-2-carboxylic acid
Molecular Mass 191.183 g·mol−1
Heat of Formation -416.7 ± 16.7 kJ·mol−1
Dipole Moment 2.53 ± 1.08 D
Volume 213.91 Å 3
Surface Area 205.89 Å 2
HOMO Energy -8.89 ± 0.55 eV
LUMO Energy -0.59 ± eV
Point Group Symmetry C1
Synonyms
  • (2s)-4-keto-2,3-dihydro-1h-quinoline-2-carboxylic acid
  • (2s)-4-oxo-2,3-dihydro-1h-quinoline-2-carboxylic acid
  • (s)-1,2,3,4-tetrahydro-4-oxo-2-quinolinecarboxylic acid
  • 2-quinolinecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-, (2s)-
  • 2-quinolinecarboxylic acid, 1,2,3,4-tetrahydro-4-oxo-, (s)-
  • 4-keto-1,2,3,4-tetrahydroquinoline-2-carboxylic acid
  • kynurenine yellow
  • quinaldic acid, 1,2,3,4-tetrahydro-4-oxo-, l-
CAS Number(s)
  • 492-26-2
InChIKey VYOPZMJTHXGKID-QMMMGPOBSA-N
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