B-Calendic Acid

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Properties Simple | Detailed

Formula C18H30O2
IUPAC Name (8e,10e,12e)-octadeca-8,10,12-trienoic acid
Molecular Mass 278.430 g·mol−1
Heat of Formation -486.0 ± 16.7 kJ·mol−1
Dipole Moment 1.70 ± 1.08 D
Volume 400.9 Å 3
Surface Area 355.84 Å 2
HOMO Energy -8.59 ± 0.55 eV
LUMO Energy -0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (8e,10e,12e)-octadeca-8,10,12-trienoic acid
  • 8e,10e,12e-octadecatrienoic acid
  • beta-calendic acid
  • lmfa01030145
  • trans-8, trans-10, trans-12-octadecatrienoic acid
InChIKey DQGMPXYVZZCNDQ-OBWVEWQSSA-N
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Elements H C O