Cas no 1253188-35-0 (4-Phenoxy-2-(trifluoromethyl)benzoic acid)
4-Phenoxy-2-(trifluoromethyl)benzoic acid Chemical and Physical Properties
Names and Identifiers
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- 4-phenoxy-2-(trifluoromethyl)benzoic acid
- 4-(Phenyloxy)-2-(trifluoromethyl)benzoic acid
- 4-Phenoxy-2-(trifluoromethyl)benzoic acid
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- 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 |
4-Phenoxy-2-(trifluoromethyl)benzoic acid Related Literature
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
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Govind Reddy Mol. Syst. Des. Eng., 2021,6, 779-789
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
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Siquan Zhang,Shengyao Wang,Liping Guo,Hao Chen,Bien Tan,Shangbin Jin J. Mater. Chem. C, 2020,8, 192-200
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Piotr Szcze?niak,Sebastian Stecko RSC Adv., 2015,5, 30882-30888
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.
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