13S-Hydroxyoctadecadienoic Acid

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Properties Simple | Detailed

Formula C18H32O3
IUPAC Name (9z,11e,13s)-13-hydroxyoctadeca-9,11-dienoic acid
Molecular Mass 296.445 g·mol−1
Heat of Formation -745.1 ± 16.7 kJ·mol−1
Dipole Moment 0.53 ± 1.08 D
Volume 425.2 Å 3
Surface Area 403.72 Å 2
HOMO Energy -9.46 ± 0.55 eV
LUMO Energy 0.31 ± eV
Point Group Symmetry C1
Synonyms
  • (13s)-hydroxyoctadecadienoic acid
  • (9z, 11e)-(13s)-13-hydroxyoctadeca-9,11-dienoic acid
  • (9z,11e,13s)-13-hydroxyoctadeca-9,11-dienoic acid
  • (r-(e,z))-13-hydroxy-9,11-octadecadienoic acid
  • 13(s)-hode
  • 13(s)-hydroxy-9(z),11(e)-octadecadienoic acid
  • 13(s)-hydroxyoctadeca-9z,11e-dienoic acid
  • 13-hydroxyoctadecadienoic acid;13-hode
  • 9,11-octadecadienoic acid, 13-hydroxy-, (r-(e,z))-
  • lmfa01050349
CAS Number(s)
  • 5204-88-6
  • 29623-28-7
  • 10219-69-9
InChIKey HNICUWMFWZBIFP-IRQZEAMPSA-N
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