(5E,8E,10E,12S)-12-Hydroxy-5,8,10-Heptadecatrienoic Acid

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Properties Simple | Detailed

Formula C17H28O3
IUPAC Name (5e,8e,10e,12s)-12-hydroxyheptadeca-5,8,10-trienoic acid
Molecular Mass 280.402 g·mol−1
Heat of Formation -626.4 ± 16.7 kJ·mol−1
Dipole Moment 2.80 ± 1.08 D
Volume 411.87 Å 3
Surface Area 356.19 Å 2
HOMO Energy -9.22 ± 0.55 eV
LUMO Energy 0.01 ± eV
Point Group Symmetry C1
Synonyms
  • (12s)-12-hydroxyheptadeca-5,8,10-trienoic acid
  • (5e,8e,10e,12s)-12-hydroxyheptadeca-5,8,10-trienoic acid
  • bio1_000098
  • bio1_000587
  • bio1_001076
  • cbiol_001812
CAS Number(s)
  • 64234-42-0
InChIKey KUKJHGXXZWHSBG-WRYGNILJSA-N
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Elements H C O