1-(Acetyloxy)-1,2-Dihydroobacunoic Acid E-Lactone

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Properties Simple | Detailed

Formula C28H34O9
IUPAC Name 1-(acetyloxy)-1,2-dihydroobacunoic acid e-lactone
Molecular Mass 514.564 g·mol−1
Heat of Formation -1385.1 ± 16.7 kJ·mol−1
Dipole Moment 5.92 ± 1.08 D
Volume 587.5 Å 3
Surface Area 422.29 Å 2
HOMO Energy -9.63 ± 0.55 eV
LUMO Energy 0.18 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(acetyloxy)-1,2-dihydroobacunoic acid .epislon.-lactone
  • 1-(acetyloxy)-1,2-dihydroobacunoic acid eta-lactone
  • obacunoic acid, 1-(acetyloxy)-1,2-dihydro-, eta-lactone
CAS Number(s)
  • 1063-77-0
InChIKey KPDOJFFZKAUIOE-WNGDLQANSA-N
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