(1S,2S,5S,8R)-9-Isopropylidene-2,6-Dimethyl-11-Oxatricyclo[6.2.1.0~1,5~]Undec-6-En-8-Ol

Molecule SVG Image

Properties Simple | Detailed

Formula C15H22O2
IUPAC Name (1s,2s,5s,8r)-9-isopropylidene-2,6-dimethyl-11-oxatricyclo[6.2.1.0 1,5 ]undec-6-en-8-ol
Molecular Mass 234.334 g·mol−1
Heat of Formation -410.6 ± 16.7 kJ·mol−1
Dipole Moment 2.78 ± 1.08 D
Volume 306.65 Å 3
Surface Area 264.06 Å 2
HOMO Energy -9.14 ± 0.55 eV
LUMO Energy 3.95 ± eV
Point Group Symmetry C1
Synonyms
  • 5-beta-guiaia-7(11),9-dien-8-alpha-ol, 5,8-epoxy-
  • 6h-3a,6-epoxyazulen-6-ol, 1,2,3,4,5,8a-hexahydro-3,8-dimethyl-5-(1-methylethylidene)-, (3s-(3-alpha,3a-alpha,6-alpha,8a-beta))-
InChIKey ISFMXVMWEWLJGJ-NZBPQXDJSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O