6-[2-(2,6-Dimethyl-1,2,6,7,8,8A-Hexahydro-1-Naphthalenyl)Ethyl]-4-Hydroxytetrahydro-2H-Pyran-2-One

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Properties Simple | Detailed

Formula C19H28O3
IUPAC Name (4r,6s)-6-[2-[(1s,2s,6r,8ar)-2,6-dimethyl-1,2,6,7,8,8a-hexahydronaphthalen-1-yl]ethyl]-4-hydroxy-tetrahydropyran-2-one
Molecular Mass 304.424 g·mol−1
Heat of Formation -606.8 ± 16.7 kJ·mol−1
Dipole Moment 4.94 ± 1.08 D
Volume 392.78 Å 3
Surface Area 341.76 Å 2
HOMO Energy -8.77 ± 0.55 eV
LUMO Energy 0.40 ± eV
Point Group Symmetry C1
InChIKey BKZPCUPKVCPRQW-USQBUYPNSA-N
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