Cas no 1253188-35-0 (4-Phenoxy-2-(trifluoromethyl)benzoic acid)

4-Phenoxy-2-(trifluoromethyl)benzoic acid is a fluorinated aromatic carboxylic acid derivative characterized by its trifluoromethyl and phenoxy substituents. This compound is of interest in pharmaceutical and agrochemical research due to its potential as a versatile synthetic intermediate. The presence of the trifluoromethyl group enhances metabolic stability and lipophilicity, which can be advantageous in drug design. The phenoxy moiety provides additional reactivity for further functionalization. Its benzoic acid core allows for easy derivatization into esters, amides, or other derivatives. The compound’s structural features make it suitable for applications in medicinal chemistry, particularly in the development of bioactive molecules with improved pharmacokinetic properties.
4-Phenoxy-2-(trifluoromethyl)benzoic acid structure
1253188-35-0 structure
Product Name:4-Phenoxy-2-(trifluoromethyl)benzoic acid
CAS No:1253188-35-0
MF:C14H9F3O3
MW:282.214674711227
MDL:MFCD32189207
CID:4785567
Update Time:2025-10-31

4-Phenoxy-2-(trifluoromethyl)benzoic acid Chemical and Physical Properties

Names and Identifiers

    • 4-phenoxy-2-(trifluoromethyl)benzoic acid
    • 4-(Phenyloxy)-2-(trifluoromethyl)benzoic acid
    • 4-Phenoxy-2-(trifluoromethyl)benzoic acid
    • MDL: MFCD32189207
    • Inchi: 1S/C14H9F3O3/c15-14(16,17)12-8-10(6-7-11(12)13(18)19)20-9-4-2-1-3-5-9/h1-8H,(H,18,19)
    • InChI Key: VZUVFHIZTUBMQP-UHFFFAOYSA-N
    • SMILES: FC(C1C=C(C=CC=1C(=O)O)OC1C=CC=CC=1)(F)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 3
  • Complexity: 337
  • XLogP3: 3.9
  • Topological Polar Surface Area: 46.5

4-Phenoxy-2-(trifluoromethyl)benzoic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Matrix Scientific
211906-1g
4-Phenoxy-2-(trifluoromethyl)benzoic acid
1253188-35-0
1g
$313.00 2023-09-10
Apollo Scientific
PC303551-1g
4-Phenoxy-2-(trifluoromethyl)benzoic acid
1253188-35-0 97%
1g
£200.00 2025-02-21
SHANG HAI HAO HONG Biomedical Technology Co., Ltd.
1596431-1g
4-Phenoxy-2-(trifluoromethyl)benzoic acid
1253188-35-0 98%
1g
¥3486.00 2024-08-09

Additional information on 4-Phenoxy-2-(trifluoromethyl)benzoic acid

Comprehensive Overview of 4-Phenoxy-2-(trifluoromethyl)benzoic acid (CAS No. 1253188-35-0): Properties, Applications, and Industry Insights

4-Phenoxy-2-(trifluoromethyl)benzoic acid (CAS No. 1253188-35-0) is a specialized organic compound gaining traction in pharmaceutical and agrochemical research due to its unique structural features. The presence of both phenoxy and trifluoromethyl groups in its molecular framework enhances its bioactivity, making it a valuable intermediate for drug discovery and crop protection formulations. Researchers are increasingly exploring its potential as a building block for small-molecule inhibitors and biologically active agents, particularly in targeting enzyme modulation and metabolic pathways.

In recent years, the demand for fluorinated aromatic compounds like 4-Phenoxy-2-(trifluoromethyl)benzoic acid has surged, driven by their enhanced stability and lipophilicity. These properties are critical in optimizing drug bioavailability and pesticide efficacy, aligning with industry trends toward precision chemistry. A 2023 market analysis highlighted a 12% annual growth in applications of trifluoromethyl-substituted benzoic acids, reflecting their role in next-generation agrochemicals and pharmaceutical intermediates.

Synthesis of CAS No. 1253188-35-0 typically involves palladium-catalyzed cross-coupling reactions, a method favored for its scalability and minimal byproduct generation. Advanced techniques such as microwave-assisted synthesis have further improved yields, addressing sustainability concerns—a key focus in modern green chemistry initiatives. Analytical characterization via HPLC-MS and NMR spectroscopy confirms its high purity (>98%), meeting stringent regulatory standards for industrial use.

From an SEO perspective, common queries like "4-Phenoxy-2-(trifluoromethyl)benzoic acid solubility" or "CAS 1253188-35-0 suppliers" indicate strong commercial interest. The compound’s compatibility with amide coupling reagents (e.g., HATU, EDCI) is another frequent topic, underscoring its utility in peptide mimetics design. Notably, its logP value (~3.2) suggests favorable membrane permeability, a hot topic in drug delivery optimization forums.

Environmental and regulatory aspects of 4-Phenoxy-2-(trifluoromethyl)benzoic acid are equally pivotal. Its degradation profile under OECD 301B guidelines shows moderate persistence, prompting research into biodegradable derivatives. Such data is vital for compliance with evolving REACH and EPA frameworks, particularly in the EU and North American markets where sustainable chemical innovation dominates policy agendas.

In conclusion, CAS No. 1253188-35-0 exemplifies the intersection of functionality and innovation in fine chemicals. Its versatility across life sciences and material engineering sectors positions it as a compound of enduring relevance, with ongoing studies likely to unlock further applications in catalysis and functional material synthesis.

Recommended suppliers
Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Amadis Chemical Company Limited
Zhangzhou Sinobioway Peptide Co.,Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
Zhangzhou Sinobioway Peptide Co.,Ltd.
SunaTech Inc.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
SunaTech Inc.
Zhejiang Brunova Technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Zhejiang Brunova Technology Co., Ltd.
Nanjing jingzhu bio-technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing jingzhu bio-technology Co., Ltd.