(1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione | CAS No. 137252-25-6

(1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione

Basic Information

CAS Number

137252-25-6

Molecular Formula

C21H28O3

Molecular Weight

328.45 g/mol

AD

Basic Physical Properties

Melting Point

48-50°C

Boiling Point

456°C at 760 mmHg

Density

1.091

Flash Point

243.7°C

Refractive Index

1.546

CCCCCC1=CC(=O)C(=C(C1=O)O)C2C=C(CCC2C(=C)C)C

InChI

InChI=1S/C21H28O3/c1-5-6-7-8-15-12-18(22)19(21(24)20(15)23)17-11-14(4)9-10-16(17)13(2)3/h11-12,16-17,24H,2,5-10H2,1,3-4H3/t16-,17+/m0/s1

InChIKey

WDXXEUARVHTWQF-DLBZAZTESA-N

LogP

5.005600000000005

Topological Polar Surface Area

54.370000000000005 Ų

Hydrogen Bond Donor/Acceptor

1 / 3

Complexity

646

Synonyms & References

English

  • CCG-208732
  • HU331
  • 2,5-Cyclohexadiene-1,4-dione, 3-hydroxy-2-(3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl)-5-pentyl-, (1R-trans)-
  • Cannabidiol hydroxyquinone
  • Cannabidiol hydroxyquinone (CBDHQ)
  • Q3825917
  • 3-hydroxy-2-[(1R,6R)-3-methyl-6-prop-1-en-2-ylcyclohex-2-en-1-yl]-5-pentylcyclohexa-2,5-diene-1,4-dione
  • BDBM50541572
  • HMS3649F22
  • J-006987
  • HU-331
  • I7Q196L4AU
  • VCE 004
  • CHEMBL4635276
  • DTXSID10929758
  • SR-01000946715-1
  • SCHEMBL13609377
  • 2,5-CYCLOHEXADIENE-1,4-DIONE, 3-HYDROXY-2-((1R,6R)-3-METHYL-6-(1-METHYLETHENYL)-2-CYCLOHEXEN-1-YL)-5-PENTYL-
  • 137252-25-6
  • CHEBI:197014
  • FS-7319
  • SR-01000946715
  • Cannabidiol hydroxyquinone (CBDHQ) 100 microg/mL in Acetonitrile
  • HU 331
  • CBDHQ
  • UNII-I7Q196L4AU
  • Cannabidiol hydroxyquinone (CBDHQ) 1000 microg/mL in Acetonitrile
  • AKOS030241459
  • 2,5-Cyclohexadiene-1,4-dione,3-hydroxy-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-cyclohexen-1-yl]-5-pentyl-
  • 3-HYDROXY-2-((1R,6R)-3-METHYL-6-(PROP-1-EN-2-YL)CYCLOHEX-2-ENYL)-5-PENTYLCYCLOHEXA-2,5-DIENE-1,4-DIONE
  • 3-HYDROXY-2-[(1R,6R)-3-METHYL-6-(1-METHYLETHENYL)-2-CYCLOHEXENE-1-YL]-5-PENTYL-2,5-CYCLOHEXADIENE-1,4-DIONE

FAQ

What regulatory guidelines apply to (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione (CAS: 137252-25-6)?

The compound (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione (CAS: 137252-25-6) falls under the scope of various regulatory guidelines, including GHS (Global Harmonized System of Classification and Labelling of Chemicals) for hazardous chemical classification, REACH (Registration, Evaluation, Authorisation and Restriction of Chemicals) in the European Union, and FDA (Food and Drug Administration) and EPA (Environmental Protection Agency) requirements in the United States. Compliance with these guidelines is crucial for safe handling and disposal.

Are there alternatives to (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione in synthesis?

While (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione (CAS: 137252-25-6) is a specific compound, there are alternative reagents and isomers that can be used in similar reactions. For example, isopropenyl cyclohexanes and related bi-cyclohexane derivatives can serve as alternatives. However, the choice of alternative depends on the specific application and the desired properties of the final product.

What is the market or research trend for (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione (CAS: 137252-25-6)?

The market for (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione (CAS: 137252-25-6) is currently stable, with a focus on its applications in pharmaceuticals and fine chemicals. Research trends suggest increasing interest in its use as a precursor in organic synthesis and as a molecule for studying biocatalytic reactions. Additionally, efforts are being made to improve its synthetic methods and to explore its potential in new applications.

How should waste containing (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione (CAS: 137252-25-6) be handled?

Waste containing (1'R,6'R)-6-Hydroxy-6'-isopropenyl-3'-methyl-4-pentyl-1,1'-bi(cyclohexane)-2',3,6-triene-2,5-dione (CAS: 137252-25-6) should be collected and disposed of according to local and international regulations. Collection should be done in labeled containers, and the waste should be treated through incineration or professional waste disposal facilities. Environmental precautions include ensuring no release into the environment and following strict safety protocols to prevent exposure to humans and wildlife.

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