Gefarnate

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Properties Simple | Detailed

Formula C27H44O2
IUPAC Name [(2e)-3,7-dimethylocta-2,6-dienyl] (4e,8e)-5,9,13-trimethyltetradeca-4,8,12-trienoate
Molecular Mass 400.637 g·mol−1
Heat of Formation -555.8 ± 16.7 kJ·mol−1
Dipole Moment 1.17 ± 1.08 D
Volume 581.43 Å 3
Surface Area 402.57 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy 0.67 ± eV
Point Group Symmetry C1
Synonyms
  • (4e,8e)-5,9,13-trimethyltetradeca-4,8,12-trienoic acid [(2e)-3,7-dimethylocta-2,6-dienyl] ester
  • (e,e,e)-5,9,13-trimethyl-4,8,12-tetradecatrienoic acid 3,7-dimethyl-2,6-octadienyl ester
  • 3,7-dimethylocta-2,6-dienyl 5,9,13-trimethyltetradeca-4,8,12-enoate
  • 3,7-dimethylocta-2,6-dienyl 5,9,13-trimethyltetradeca-4,8,12-trienoate
  • 4,8,12-tetradecatrienoic acid, 5,9,13-trimethyl-, (2e)-3,7-dimethyl-2,6-octadienyl ester, (4e,8e)-
  • 4,8,12-tetradecatrienoic acid, 5,9,13-trimethyl-, 3,7-dimethyl-2,6-octadienyl ester, (e,e,e)-
  • 5,9,13-trimethyl-4,8,12-tetradecatrienoic acid 3,7-dimethyl-2,6-octadienyl ester
  • 5,9,13-trimethyltetradeca-4,8,12-trienoic acid 3,7-dimethylocta-2,6-dienyl ester
  • 5,9,13-trimethyltetradeca-4,8,12-trienoic acid [(2e)-3,7-dimethylocta-2,6-dienyl] ester
  • [(2e)-3,7-dimethylocta-2,6-dienyl] (4e,8e)-5,9,13-trimethyltetradeca-4,8,12-trienoate
  • [(2e)-3,7-dimethylocta-2,6-dienyl] 5,9,13-trimethyltetradeca-4,8,12-trienoate
  • da-688
  • gefamate
  • gefarnate [ban:inn:jan]
  • gefarnil
  • gefarnyl
  • geranyl farnesylacetate
  • osteol
  • trans-3,7-dimethyl-2,6-octadienyl 5,9,13-trimethyl-4,8,12-tetradecatrienoate
CAS Number(s)
  • 30462-47-6
  • 51-77-4
  • 16898-88-7
InChIKey ZPACYDRSPFRDHO-ROBAGEODSA-N
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