Basic information
- CAS
34984-78-6- Standard SMILES
CCCCCc1cc(O)c2c(c1)OC(C)(C)[C@@H]1C[C@@H](O)C(C)=C[C@@H]21- InChIKey
INKUWBOHCFHXTJ-BRWVUGGUSA-N- Molecular formula
- C21H30O3
- Average molar mass
- 330.5 g/mol
- Monoisotopic mass
- 330.21949481
Overview
8-Hydroxy-delta(9)-tetrahydrocannabinol has been reported in Cannabis sativa with data available.
Names & identifiers
- Preferred name
- 8-Hydroxy-delta(9)-tetrahydrocannabinol
- IUPAC
- (6aR,8R,10aR)-6,6,9-trimethyl-3-pentyl-6a,7,8,10a-tetrahydrobenzo[c]chromene-1,8-diol
- English name
- 8-hydroxy-delta(9)-tetrahydrocannabinol
- Molecular formula
- C21H30O3
- Molecular weight
- 330.46
Names & synonyms
34984-78-68-Ohthc8-Hydroxy-delta(9)-tetrahydrocannabinol671A0K1FQE8 beta-Hydroxy-delta(9)-tetrahyrocannabinolDTXSID101885256H-Dibenzo(b,d)pyran-1,8-diol, 6a,7,8,10a-tetrahydro-6,6,9-trimethyl-3-pentyl-, (6aR-(6aalpha,8alpha,10abeta))-RefChem:9145808 beta-hydroxy-delta (9)-THC8 alpha-hydroxy-delta (9)-THCDTXCID70111016TO89JGK3SC
Show more names
8β-OH-Δ9-THC(6aR,8R,10aR)-8-Hydroxy-9-THC8β-hydroxy-Δ9-THC8-Hydroxy-9-tetrahydrocannabinol8β-Hydroxy-?9-tetrahydro Cannabinol(-)-8-Hydroxy-9-tetrahydrocannabinol8β-hydroxy-Δ9-THC (exempt preparation)(6aR)-6aβ,7,8,10aα-Tetrahydro-6,6,9-trimethyl-3-pentyl-6H-dibenzo[b,d]pyran-1,8β-diol
8beta-Hydroxy-delta (9)-thc8alpha-Hydroxy-delta (9)-thcTHC, 8 beta-OHUNII-671A0K1FQECHEMBL3586105SCHEMBL23043730BDBM84880(6aR,8R,10aR)-6,6,9-Trimethyl-3-pentyl-6H,6ah,7H,8H,10ah-benzo(C)isochromene-1,8-diol
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 49.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 470
Physicochemical properties
- Boiling point
- 430.3 · 430.3±45.0 °C(Predicted)
- Density
- 1.077 · 1.077±0.06 g/cm3(Predicted)
- solubility
- 50 mg/ml · Acetonitrile: 50 mg/ml
- form
- A crystalline solid
- pka
- 9.75 · 9.75±0.70(Predicted)
- FDA UNII
- 671 A0K1FQE · 671A0K1FQE
Chemistry & industry
Applications
UsesA metabolite of 9-tetrahydrocannabinol (9-THC).
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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