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

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Properties Simple | Detailed

Formula C18H32O4
IUPAC Name (9z,11e,13r)-13-hydroperoxyoctadeca-9,11-dienoic acid
Molecular Mass 312.444 g·mol−1
Heat of Formation -650.5 ± 16.7 kJ·mol−1
Dipole Moment 2.48 ± 1.08 D
Volume 435.99 Å 3
Surface Area 417.0 Å 2
HOMO Energy -9.28 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
Synonyms
  • (9z,11e,13r)-13-hydroperoxyoctadeca-9,11-dienoic acid
  • 13(r)-hydroperoxy-9(z),11(e)-octadecadienoic acid
  • 13r
  • lmfa02000034
InChIKey JDSRHVWSAMTSSN-PIHGWCCBSA-N
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Elements H C O