Cas no 54102-37-3 (Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)-)

Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)-, is a substituted benzoic acid derivative characterized by a hydroxyl group at the 2-position, a methyl group at the 6-position, and a benzyloxy moiety at the 4-position. This structural configuration imparts unique reactivity and functional properties, making it valuable in synthetic organic chemistry and pharmaceutical intermediates. The presence of multiple substituents enhances its potential as a building block for complex molecular frameworks. Its stability under standard conditions and compatibility with various reaction conditions further contribute to its utility in research and industrial applications. The compound is typically handled with standard laboratory precautions due to its moderate reactivity.
Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- structure
54102-37-3 structure
Product Name:Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)-
CAS No:54102-37-3
MF:C15H14O4
MW:258.269264698029
MDL:MFCD02113688
CID:355538
PubChem ID:70229521
Update Time:2025-05-20

Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- Chemical and Physical Properties

Names and Identifiers

    • Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)-
    • 2-hydroxy-6-methyl-4-phenylmethoxybenzoic acid
    • 54102-37-3
    • SCHEMBL7921994
    • 4-(Benzyloxy)-2-hydroxy-6-methylbenzoic acid
    • 4-benzyloxy-2-hydroxy-6-methylbenzoic acid
    • DTXSID10741755
    • MDL: MFCD02113688
    • Inchi: 1S/C15H14O4/c1-10-7-12(8-13(16)14(10)15(17)18)19-9-11-5-3-2-4-6-11/h2-8,16H,9H2,1H3,(H,17,18)
    • InChI Key: SESUNWLPIOCOJI-UHFFFAOYSA-N
    • SMILES: O(CC1C=CC=CC=1)C1C=C(C(C(=O)O)=C(C)C=1)O

Computed Properties

  • Exact Mass: 258.08922
  • Monoisotopic Mass: 258.08920892g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 299
  • 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: 3.5
  • Topological Polar Surface Area: 66.8?2

Experimental Properties

  • PSA: 66.76

Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- Pricemore >>

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Additional information on Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)-

Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- (CAS No. 54102-37-3): A Comprehensive Overview of Its Applications and Recent Research Findings

Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)-, identified by its CAS number 54102-37-3, is a versatile organic compound with significant applications in pharmaceuticals, agrochemicals, and material science. This compound, characterized by its hydroxyl and methoxy substituents on a benzene ring, exhibits unique chemical properties that make it valuable in various synthetic processes and biological systems.

The structure of Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- consists of a benzene core substituted with a hydroxyl group at the 2-position, a methyl group at the 6-position, and a phenylmethoxy group at the 4-position. This specific arrangement imparts distinct reactivity and functionality, making it a compound of interest in organic synthesis and drug development.

In recent years, research on Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- has focused on its potential applications in medicinal chemistry. The compound's ability to act as a precursor in the synthesis of more complex molecules has been explored extensively. For instance, its derivatives have been investigated for their antimicrobial and anti-inflammatory properties.

One of the most compelling aspects of Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- is its role in the development of novel pharmaceutical agents. Researchers have leveraged its structural features to create compounds with enhanced bioavailability and reduced toxicity. The hydroxyl group, in particular, serves as a key site for further functionalization, allowing chemists to tailor the molecule for specific therapeutic targets.

The agrochemical industry has also benefited from the study of Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)-. Its derivatives have been found to possess herbicidal and pesticidal properties, making them valuable in crop protection strategies. The compound's stability under various environmental conditions further enhances its utility in agricultural applications.

In material science, Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- has been utilized as an intermediate in the synthesis of polymers and coatings. Its aromatic structure contributes to the formation of materials with improved mechanical strength and thermal stability. These properties are particularly relevant in the development of advanced materials for industrial use.

The synthesis of Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- involves multi-step organic reactions that highlight the compound's synthetic versatility. Recent advancements in catalytic methods have enabled more efficient and environmentally friendly production processes. These innovations not only improve yield but also reduce waste, aligning with global sustainability goals.

Epidemiological studies have begun to explore the biological activity of Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- and its derivatives. Preliminary findings suggest that certain analogs may exhibit potential benefits in metabolic regulation and neuroprotection. These discoveries open new avenues for therapeutic intervention in chronic diseases.

The regulatory landscape for compounds like Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- is continually evolving to ensure safety and efficacy. Regulatory bodies are closely monitoring new research findings to update guidelines for pharmaceutical and agrochemical use. This proactive approach ensures that innovative applications are balanced with responsible stewardship.

The future prospects for Benzoic acid, 2-hydroxy-6-methyl-4-(phenylmethoxy)- are promising, with ongoing research expected to uncover new applications across multiple industries. Collaborative efforts between academia and industry will be crucial in translating laboratory discoveries into practical solutions. As our understanding of this compound grows, so too will its impact on science and technology.

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