(6Ar,9S,10S,10Ar)-6,6,9-Trimethyl-3-Pentyl-6A,7,8,9,10,10A-Hexahydro-6H-Benzo[C]Chromene-1,9,10-Triol

Molecule SVG Image

Properties Simple | Detailed

Formula C21H32O4
IUPAC Name (6ar,9s,10s,10ar)-6,6,9-trimethyl-3-pentyl-7,8,10,10a-tetrahydro-6ah-benzo[c]chromene-1,9,10-triol
Molecular Mass 348.476 g·mol−1
Heat of Formation -925.3 ± 16.7 kJ·mol−1
Dipole Moment 2.59 ± 1.08 D
Volume 444.19 Å 3
Surface Area 374.54 Å 2
HOMO Energy -8.94 ± 0.55 eV
LUMO Energy 0.21 ± eV
Point Group Symmetry C1
Synonyms
  • (6ar,9s,10s,10ar)-3-amyl-6,6,9-trimethyl-7,8,10,10a-tetrahydro-6ah-benzo[c]chromene-1,9,10-triol
  • (6ar,9s,10s,10ar)-6,6,9-trimethyl-3-pentyl-7,8,10,10a-tetrahydro-6ah-benzo[c]chromene-1,9,10-triol
  • (6ar,9s,10s,10ar)-9,10-dihydroxyhexahydrocannabinol
  • 6h-dibenzo(b,d)pyran-1,9,10-triol, 6a,7,8,9,10,10a-hexahydro-6,6,9-trimethyl-3-pentyl-, (6ar-(6aalpha,9beta,10alpha,10abeta))-
  • cannabiripsol
CAS Number(s)
  • 72236-32-9
InChIKey TZGCTXUTNDNTTE-DYZHCLJRSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O