6-[2-(2,6-Dimethyl-1,2,6,7,8,8A-Hexahydro-1-Naphthalenyl)Ethyl]-4-Hydroxytetrahydro-2H-Pyran-2-One
Properties
Property | Value |
---|---|
Formula | C19H28O3 |
IUPAC Name | (4r,6r)-6-[2-[(1s,2s,6r)-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 |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |