Cas no 1261897-84-0 (5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol)

5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol is a fluorinated aromatic compound featuring both carboxylic acid and phenol functional groups, making it a versatile intermediate in organic synthesis. The presence of electron-withdrawing trifluoromethyl and dicarboxyphenyl groups enhances its reactivity in cross-coupling and condensation reactions, particularly in pharmaceutical and agrochemical applications. Its trifluoromethyl group contributes to improved metabolic stability and lipophilicity in derived compounds. The dual carboxyl groups allow for further functionalization, enabling the synthesis of complex molecular architectures. This compound is valued for its structural rigidity and potential utility in designing high-performance materials and bioactive molecules. Suitable for controlled reactions, it offers precise modification opportunities in advanced chemical research.
5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol structure
1261897-84-0 structure
Product Name:5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol
CAS No:1261897-84-0
MF:C15H9F3O5
MW:326.224175214767
MDL:MFCD18316445
CID:2762038
PubChem ID:53222168
Update Time:2025-10-29

5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol Chemical and Physical Properties

Names and Identifiers

    • MFCD18316445
    • 1261897-84-0
    • 3'-Hydroxy-5'-(trifluoromethyl)[1,1'-biphenyl]-3,5-dicarboxylic acid
    • DTXSID00686742
    • 5-(3,5-DICARBOXYPHENYL)-3-TRIFLUOROMETHYLPHENOL
    • 5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol, 95%
    • 5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol
    • MDL: MFCD18316445
    • Inchi: 1S/C15H9F3O5/c16-15(17,18)11-4-8(5-12(19)6-11)7-1-9(13(20)21)3-10(2-7)14(22)23/h1-6,19H,(H,20,21)(H,22,23)
    • InChI Key: RIDNEJJQTMMYQG-UHFFFAOYSA-N
    • SMILES: FC(C1=CC(=CC(=C1)C1C=C(C(=O)O)C=C(C(=O)O)C=1)O)(F)F

Computed Properties

  • Exact Mass: 326.04020787Da
  • Monoisotopic Mass: 326.04020787Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 3
  • Complexity: 443
  • 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: 3.1
  • Topological Polar Surface Area: 94.8?2

5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB322653-5 g
5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol, 95%; .
1261897-84-0 95%
5g
€1159.00 2023-04-26
abcr
AB322653-5g
5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol, 95%; .
1261897-84-0 95%
5g
€1159.00 2025-04-21

Additional information on 5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol

5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol: A Comprehensive Overview

The compound 5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol, identified by the CAS Registry Number 1261897-84-0, is a highly specialized organic molecule with significant potential in various chemical and pharmaceutical applications. This compound is characterized by its unique structure, which includes a phenolic hydroxyl group, a trifluoromethyl substituent, and two carboxylic acid groups attached to the aromatic ring system. The presence of these functional groups imparts the molecule with versatile chemical properties, making it an interesting subject for both academic research and industrial development.

Recent studies have highlighted the importance of this compound in the field of materials science, where its ability to form stable polymeric networks has been extensively explored. Researchers have demonstrated that the dicarboxylic acid groups in the molecule can act as reactive sites for polymerization reactions, leading to the synthesis of high-performance polymers with enhanced mechanical and thermal properties. These polymers have potential applications in advanced composites, biodegradable materials, and electronic devices.

In addition to its role in materials science, 5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol has shown promise in the field of pharmaceutical chemistry. The trifluoromethyl group is known to enhance the lipophilicity of a molecule, which can improve its bioavailability when used as a drug candidate. Furthermore, the phenolic hydroxyl group can participate in hydrogen bonding interactions, potentially enhancing the molecule's ability to interact with biological targets such as enzymes or receptors.

The synthesis of this compound typically involves multi-step organic reactions, including Friedel-Crafts acylation and subsequent oxidation or substitution reactions to introduce the carboxylic acid groups. Recent advancements in catalytic methods have enabled more efficient and environmentally friendly syntheses of this compound, reducing production costs and minimizing waste generation.

From an environmental perspective, this compound has been investigated for its potential use in waste water treatment. The carboxylic acid groups can act as chelating agents, enabling the molecule to bind and remove heavy metal ions from contaminated water sources. This application aligns with current global efforts to develop sustainable solutions for pollution control and resource recovery.

In conclusion, 5-(3,5-Dicarboxyphenyl)-3-trifluoromethylphenol (CAS No. 1261897-84-0) is a versatile compound with a wide range of potential applications across multiple disciplines. Its unique chemical structure and functional groups make it an attractive target for further research and development in areas such as materials science, pharmaceutical chemistry, and environmental remediation.

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