Methyl (2S)-2-{(6R)-6-[2-(1-Hydroxy-2,2-Dimethyl-6-Methylenecyclohexyl)Ethyl]-6-Methyl-1,2-Dioxan-3-Yl}Propanoate

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Properties Simple | Detailed

Formula C20H34O5
IUPAC Name methyl (2s)-2-[(3s,6r)-6-[2-[(1s)-1-hydroxy-2,2-dimethyl-6-methylene-cyclohexyl]ethyl]-6-methyl-dioxan-3-yl]propanoate
Molecular Mass 354.481 g·mol−1
Heat of Formation -877.9 ± 16.7 kJ·mol−1
Dipole Moment 3.01 ± 1.08 D
Volume 457.87 Å 3
Surface Area 344.01 Å 2
HOMO Energy -9.41 ± 0.55 eV
LUMO Energy 0.89 ± eV
Point Group Symmetry C1
InChIKey OHYYIYQJXHASNH-XAMWDVODSA-N
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Elements H C O