(4R,6R,7S,8E)-7-Hydroxy-4-Methyl-2-Oxo-3,11-Dioxabicyclo[8.1.0]Undec-8-En-6-Yl (2E)-2-Butenoate

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Properties Simple | Detailed

Formula C14H18O6
IUPAC Name [(1s,2e,4s,5r,7r,10s)-4-hydroxy-7-methyl-9-oxo-8,11-dioxabicyclo[8.1.0]undec-2-en-5-yl] (e)-but-2-enoate
Molecular Mass 282.289 g·mol−1
Heat of Formation -876.8 ± 16.7 kJ·mol−1
Dipole Moment 2.43 ± 1.08 D
Volume 333.46 Å 3
Surface Area 287.24 Å 2
HOMO Energy -10.19 ± 0.55 eV
LUMO Energy -0.33 ± eV
Point Group Symmetry C1
InChIKey MKNCRDRXKFGNDG-XISLUHNPSA-N
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