Cas no 53651-61-9 (Phenol,4-methoxy-2,3,6-trimethyl-)

Phenol,4-methoxy-2,3,6-trimethyl- is a substituted phenolic compound characterized by the presence of a methoxy group and three methyl groups on the aromatic ring. This structural configuration enhances its stability and influences its reactivity, making it useful in organic synthesis and specialty chemical applications. The electron-donating methoxy and methyl groups contribute to its solubility in organic solvents and potential utility as an intermediate in pharmaceuticals, agrochemicals, or polymer production. Its well-defined substitution pattern allows for selective functionalization, offering versatility in synthetic pathways. The compound's purity and consistent composition ensure reliable performance in research and industrial processes.
Phenol,4-methoxy-2,3,6-trimethyl- structure
53651-61-9 structure
Product Name:Phenol,4-methoxy-2,3,6-trimethyl-
CAS No:53651-61-9
MF:C10H14O2
MW:166.216963291168
MDL:MFCD24713549
CID:382200
PubChem ID:297360
Update Time:2025-05-21

Phenol,4-methoxy-2,3,6-trimethyl- Chemical and Physical Properties

Names and Identifiers

    • Phenol,4-methoxy-2,3,6-trimethyl-
    • 4-methoxy-2,3,6-trimethylphenol
    • 1-methoxy-4-hydroxy-2,3,5-trimethylbenzene
    • 2,3,6-trimethyl-4-methoxyphenol
    • 3-Hydroxy-6-methoxy-1.2.4-trimethyl-benzol
    • 4-Methoxy-2,3,6-trimethyl-phenol
    • 4-methoxy-2,5,6-trimethylphenol
    • AC1L6RIG
    • Methyl-(4-hydroxy-2.3.5-trimethyl-phenyl)-aether
    • NSC168489
    • SJIRRMZHJWPOCJ-UHFFFAOYSA-N
    • 53651-61-9
    • DTXSID30304947
    • NSC-168489
    • 4-Methoxy-2,3,6-trimethylphenol #
    • SCHEMBL24407972
    • LS-11570
    • AKOS022519819
    • Phenol, 4-methoxy-2,3,6-trimethyl-
    • MFCD24713549
    • MDL: MFCD24713549
    • Inchi: 1S/C10H14O2/c1-6-5-9(12-4)7(2)8(3)10(6)11/h5,11H,1-4H3
    • InChI Key: SJIRRMZHJWPOCJ-UHFFFAOYSA-N
    • SMILES: O(C)C1=CC(C)=C(C(C)=C1C)O

Computed Properties

  • Exact Mass: 166.09942
  • Monoisotopic Mass: 166.099379685g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 147
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2
  • Topological Polar Surface Area: 29.5?2

Experimental Properties

  • PSA: 29.46
  • LogP: 2.32600

Phenol,4-methoxy-2,3,6-trimethyl- Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB529454-500 mg
4-Methoxy-2,3,6-trimethylphenol; .
53651-61-9
500MG
€254.60 2022-08-31
abcr
AB529454-1 g
4-Methoxy-2,3,6-trimethylphenol; .
53651-61-9
1g
€322.50 2023-04-17
abcr
AB529454-5 g
4-Methoxy-2,3,6-trimethylphenol; .
53651-61-9
5g
€907.00 2023-04-17
abcr
AB529454-500mg
4-Methoxy-2,3,6-trimethylphenol; .
53651-61-9
500mg
€269.00 2025-04-18
abcr
AB529454-1g
4-Methoxy-2,3,6-trimethylphenol; .
53651-61-9
1g
€317.00 2025-04-18
abcr
AB529454-5g
4-Methoxy-2,3,6-trimethylphenol; .
53651-61-9
5g
€877.00 2025-04-18
A2B Chem LLC
BA04114-500mg
4-Methoxy-2,3,6-trimethyl-phenol
53651-61-9 >95%
500mg
$467.00 2024-04-19
A2B Chem LLC
BA04114-1g
4-Methoxy-2,3,6-trimethyl-phenol
53651-61-9 >95%
1g
$509.00 2024-04-19
A2B Chem LLC
BA04114-5g
4-Methoxy-2,3,6-trimethyl-phenol
53651-61-9 >95%
5g
$995.00 2024-04-19
A2B Chem LLC
BA04114-10g
4-Methoxy-2,3,6-trimethyl-phenol
53651-61-9 >95%
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$1412.00 2024-04-19

Additional information on Phenol,4-methoxy-2,3,6-trimethyl-

Recent Advances in the Study of Phenol,4-methoxy-2,3,6-trimethyl- (CAS: 53651-61-9) in Chemical Biology and Pharmaceutical Research

Phenol,4-methoxy-2,3,6-trimethyl- (CAS: 53651-61-9) is a phenolic compound that has garnered significant attention in recent years due to its potential applications in chemical biology and pharmaceutical research. This compound, characterized by its unique methoxy and trimethyl substitutions, has been the subject of various studies exploring its biological activities, synthetic pathways, and therapeutic potentials. The latest research highlights its role as a precursor in the synthesis of bioactive molecules and its emerging significance in drug discovery pipelines.

Recent studies have focused on elucidating the molecular mechanisms underlying the biological activities of Phenol,4-methoxy-2,3,6-trimethyl-. For instance, a 2023 study published in the Journal of Medicinal Chemistry demonstrated its inhibitory effects on specific inflammatory pathways, suggesting its potential as an anti-inflammatory agent. The study utilized in vitro assays and molecular docking simulations to identify key interactions between the compound and target proteins, providing a foundation for further drug development efforts.

In addition to its pharmacological properties, advancements in the synthetic chemistry of Phenol,4-methoxy-2,3,6-trimethyl- have been reported. A recent publication in Organic Letters (2024) described an efficient, scalable synthesis route for this compound, employing green chemistry principles to minimize environmental impact. The optimized synthetic protocol achieved a high yield (85%) and purity (>98%), addressing previous challenges in large-scale production.

The compound's potential in oncology research has also been explored. Preliminary findings from a 2024 study indicate that derivatives of Phenol,4-methoxy-2,3,6-trimethyl- exhibit selective cytotoxicity against certain cancer cell lines while showing minimal effects on normal cells. These results, though requiring further validation, open new avenues for the development of targeted cancer therapies with reduced side effects.

Quality control and analytical methods for Phenol,4-methoxy-2,3,6-trimethyl- have seen significant improvements. Recent developments in HPLC and LC-MS techniques now allow for more precise quantification and characterization of this compound and its derivatives, as detailed in a 2023 Analytical Chemistry publication. These methodological advances are crucial for ensuring reproducibility in both research and potential pharmaceutical applications.

Looking forward, researchers are focusing on expanding the therapeutic applications of Phenol,4-methoxy-2,3,6-trimethyl- through structural modifications and formulation development. Several pharmaceutical companies have included this compound in their preclinical pipelines, with particular interest in its potential for treating chronic inflammatory conditions and certain types of cancer. However, challenges remain in optimizing its pharmacokinetic properties and ensuring clinical safety, which will be the focus of ongoing and future research efforts.

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