Methyl {(3S,4R,6S)-4,6-Diethyl-6-[(1E,5E)-4-Ethyl-2-Methyl-1,5-Octadien-1-Yl]-1,2-Dioxan-3-Yl}Acetate

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Properties Simple | Detailed

Formula C22H38O4
IUPAC Name methyl 2-[(3s,4s,6s)-4,6-diethyl-6-[(1e,4r,5e)-4-ethyl-2-methyl-octa-1,5-dienyl]dioxan-3-yl]acetate
Molecular Mass 366.535 g·mol−1
Heat of Formation -678.5 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 506.92 Å 3
Surface Area 412.86 Å 2
HOMO Energy -9.27 ± 0.55 eV
LUMO Energy 0.65 ± eV
Point Group Symmetry C1
InChIKey BUJRRZDBOYIMBT-MSFQRKHCSA-N
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