1-Hydroxy-6,6,9-Trimethyl-3-Pentyl-6H-Benzo[C]Chromene-2-Carboxylic Acid

Molecule SVG Image

Properties Simple | Detailed

Formula C22H26O4
IUPAC Name 1-hydroxy-6,6,9-trimethyl-3-pentyl-benzo[c]chromene-2-carboxylic acid
Molecular Mass 354.439 g·mol−1
Heat of Formation -784.7 ± 16.7 kJ·mol−1
Dipole Moment 1.82 ± 1.08 D
Volume 430.57 Å 3
Surface Area 372.56 Å 2
HOMO Energy -8.65 ± 0.55 eV
LUMO Energy -0.56 ± eV
Point Group Symmetry C1
Synonyms
  • 1-hydroxy-6,6,9-trimethyl-3-pentyl-2-benzo[c]chromenecarboxylic acid
  • 1-hydroxy-6,6,9-trimethyl-3-pentylbenzo[c]chromene-2-carboxylic acid
  • 3-amyl-1-hydroxy-6,6,9-trimethyl-benzo[c]chromene-2-carboxylic acid
  • 6h-dibenzo(b,d)pyran-2-carboxylic acid, 1-hydroxy-6,6,9-trimethyl-3-pentyl-
  • cannabinolic acid
CAS Number(s)
  • 2808-39-1
InChIKey KXKOBIRSQLNUPS-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O