(9E,12S)-12-Hydroxy-9-Octadecenoic Acid

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Properties Simple | Detailed

Formula C18H34O3
IUPAC Name (e,12s)-12-hydroxyoctadec-9-enoic acid
Molecular Mass 298.461 g·mol−1
Heat of Formation -869.0 ± 16.7 kJ·mol−1
Dipole Moment 3.38 ± 1.08 D
Volume 434.07 Å 3
Surface Area 341.1 Å 2
HOMO Energy -9.69 ± 0.55 eV
LUMO Energy 0.97 ± eV
Point Group Symmetry C1
Synonyms
  • (e,12s)-12-hydroxyoctadec-9-enoic acid
  • 12s-hydroxy-9e-octadecenoic acid
  • 9-octadecenoic acid, 12-hydroxy-, [s-(e)]-
  • 9-octadecenoic acid, 12-hydroxy-, calcium salt, (9z,12r)-
  • lmfa01050305
  • ricinoleic acid, calcium salt
CAS Number(s)
  • 31983-33-2
InChIKey WBHHMMIMDMUBKC-KQPPXVQYSA-N
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