(9Z,11E,13S)-13-Hydroperoxy-9,11-Octadecadienoic Acid

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Properties Simple | Detailed

Formula C18H32O4
IUPAC Name (9z,11e,13s)-13-hydroperoxyoctadeca-9,11-dienoic acid
Molecular Mass 312.444 g·mol−1
Heat of Formation -661.8 ± 16.7 kJ·mol−1
Dipole Moment 0.88 ± 1.08 D
Volume 442.32 Å 3
Surface Area 373.36 Å 2
HOMO Energy -9.20 ± 0.55 eV
LUMO Energy -0.04 ± eV
Point Group Symmetry C1
Synonyms
  • (13s,9z,11e)-13-hydroperoxy-9,11-octadecadienoic acid
  • (9z,11e)-(13s)-13-hydroperoxyoctadeca-9,11-dienoate
  • (9z,11e)-(13s)-13-hydroperoxyoctadeca-9,11-dienoic acid
  • (9z,11e,13s)-13-hydroperoxyoctadeca-9,11-dienoic acid
  • 13(s)-hpode
  • 13(s)-hydroperoxy-9(z),11(e)-octadecadienoic acid
  • 13(s)-hydroperoxy-9z,11e-octadecadienoic acid
  • 13(s)-hydroperoxylinoleic acid
  • 13-hydroperoxy-9,11e-octadecadienoic acid
  • 13-l-hydroperoxy-9-cis,11-trans-octadecadienoic acid
  • 13-l-hydroperoxylinoleic acid
  • 13s
  • 13s-hydroperoxy-9z,11e-octadecadienoic acid
  • 9,11-octadecadienoic acid, 13-hydroperoxy-, (9z,11e,13s)-
  • 9,11-octadecadienoic acid, 13-hydroperoxy-, (9z,11e,13s)- (9ci)
  • 9,11-octadecadienoic acid, 13-hydroperoxy-, (e,z)-l- (8ci)
  • 9,11-octadecadienoic acid, 13-hydroperoxy-, [s-(e,z)]-
  • hpode
  • linoleic acid 13(s)-hydroperoxide
  • linoleic acid, 13-hydroperoxy-, l-
  • lmfa01040001
CAS Number(s)
  • 33964-75-9
InChIKey JDSRHVWSAMTSSN-IRQZEAMPSA-N
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