(6Ar,10Ar)-1-Hydroxy-6,6,9-Trimethyl-3-Pentyl-6A,7,8,10A-Tetrahydro-6H-Benzo[C]Chromene-2-Carboxylic Acid

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Properties Simple | Detailed

Formula C22H30O4
IUPAC Name (6ar,10ar)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylic acid
Molecular Mass 358.471 g·mol−1
Heat of Formation -866.6 ± 16.7 kJ·mol−1
Dipole Moment 2.62 ± 1.08 D
Volume 447.86 Å 3
Surface Area 385.01 Å 2
HOMO Energy -9.02 ± 0.55 eV
LUMO Energy -0.34 ± eV
Point Group Symmetry C1
Synonyms
  • (6ar,10ar)-1-hydroxy-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylic acid
  • (6ar,10ar)-3-amyl-1-hydroxy-6,6,9-trimethyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-2-carboxylic acid
  • 6h-dibenzo(b,d)pyran-2-carboxylic acid, 6a,7,8,10a-tetrahydro-1-hydroxy-6,6,9-trimethyl-3-pentyl-, (6ar,10ar)-
  • 6h-dibenzo(b,d)pyran-2-carboxylic acid, 6abeta,7,8,10a-tetrahydro-1-hydroxy-6,6,9-trimethyl-3-pentyl-, (6ar-trans)-
  • 9-carboxy-delta(9)-thc
  • 9-carboxy-thc
  • delta(9)-tetrahydrocannabinolic acid
  • thc-9-cooh
CAS Number(s)
  • 23978-85-0
InChIKey UCONUSSAWGCZMV-HZPDHXFCSA-N
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