(6Ar,9R,10Ar)-9-(Hydroxymethyl)-6,6-Dimethyl-3-Pentyl-6A,7,8,9,10,10A-Hexahydro-6H-Benzo[C]Chromen-1-Ol

Molecule SVG Image

Properties Simple | Detailed

Formula C21H32O3
IUPAC Name (6ar,9r,10ar)-9-(hydroxymethyl)-6,6-dimethyl-3-pentyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol
Molecular Mass 332.477 g·mol−1
Heat of Formation -718.8 ± 16.7 kJ·mol−1
Dipole Moment 1.45 ± 1.08 D
Volume 436.39 Å 3
Surface Area 378.28 Å 2
HOMO Energy -8.75 ± 0.55 eV
LUMO Energy 0.42 ± eV
Point Group Symmetry C1
Synonyms
  • (6ar,9r,10ar)-3-amyl-6,6-dimethyl-9-methylol-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol
  • (6ar,9r,10ar)-9-(hydroxymethyl)-6,6-dimethyl-3-pentyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-1-ol
  • 6h-dibenzo(b,d)pyran-9-methanol, 6a,7,8,9,10,10a-hexahydro-1-hydroxy-6,6-dimethyl-3-phenyl-, (6ar-(6aalpha,9alpha,10abeta))-
  • 7-hydroxyhexahydrocannabinol
  • nl 105
  • nl 106
  • nl-105
CAS Number(s)
  • 64663-39-4
InChIKey LXSFNMQURHTPIT-BRWVUGGUSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O