(3S,3Ar,4Ar,5S,6R,7Ar,9As)-5,6-Dihydroxy-3,5,8-Trimethyl-3A,4,4A,5,6,7,7A,9A-Octahydroazuleno[6,5-B]Furan-2(3H)-One

Molecule SVG Image

Properties Simple | Detailed

Formula C15H22O4
IUPAC Name (1s,3as,5ar,7r,8s,8ar,9ar)-7,8-dihydroxy-1,5,8-trimethyl-1,3a,5a,6,7,8a,9,9a-octahydroazuleno[6,5-b]furan-2-one
Molecular Mass 266.333 g·mol−1
Heat of Formation -766.0 ± 16.7 kJ·mol−1
Dipole Moment 3.21 ± 1.08 D
Volume 327.33 Å 3
Surface Area 274.73 Å 2
HOMO Energy -9.83 ± 0.55 eV
LUMO Energy 0.57 ± eV
Point Group Symmetry C1
Synonyms
  • (1s,3as,5ar,7r,8s,8ar,9ar)-7,8-dihydroxy-1,5,8-trimethyl-1,3a,5a,6,7,8a,9,9a-octahydroazuleno[5,6-d]furan-2-one
InChIKey XXFLOPBDRWUQBW-IJNXQFBFSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O