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Benzoic Acid, 4-Methoxy-3-(Trifluoromethyl)-, Methyl Ester CAS NO 576170-42-8
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CAS No.:576170-42-8
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
Benzoic Acid, 4-Methoxy-3-(Trifluoromethyl)-, Methyl Ester is a high-purity, fluorinated aromatic ester building block of significant interest in advanced chemical synthesis. This compound matters for its unique trifluoromethyl and methoxy substituents, which are critical for modulating the lipophilicity, metabolic stability, and binding affinity of target molecules. It is primarily needed by research and development teams in the pharmaceutical and agrochemical industries for the creation of novel active ingredients.
Application
- Pharmaceutical Intermediate: A key synthon in the research and development of new drug candidates, particularly in medicinal chemistry programs targeting CNS, oncology, and anti-inflammatory applications.
- Agrochemical Synthesis: Used as a building block for developing advanced herbicides, fungicides, and insecticides, where the trifluoromethyl group enhances biological activity and environmental stability.
- Liquid Crystal & OLED Materials: Serves as a precursor in the synthesis of fluorinated aromatic cores for electronic materials, contributing to improved performance in display and lighting technologies.
- Organic Synthesis & Catalysis: Employed in cross-coupling reactions and as a specialty reagent for introducing the 4-methoxy-3-(trifluoromethyl)benzoyl moiety into complex molecular architectures.
- Chemical Research: Used in academic and industrial R&D laboratories for studying structure-activity relationships (SAR) and developing novel synthetic methodologies.
Basic Information
| Product Name | Benzoic Acid, 4-Methoxy-3-(Trifluoromethyl)-, Methyl Ester |
| CAS No. | 576170-42-8 |
| Molecular Formula | C10H9F3O3 |
| Molecular Weight | 234.17 g/mol |
| Synonyms | 4-Methoxy-3-(trifluoromethyl)benzoic acid methyl ester; Methyl 4-methoxy-3-(trifluoromethyl)benzoate; 3-Trifluoromethyl-4-methoxy methyl benzoate; Methyl 3-(trifluoromethyl)-4-methoxybenzoate; 4-Methoxy-α,α,α-trifluoro-m-toluic acid methyl ester; Benzoic acid, 4-methoxy-3-(trifluoromethyl)-, methyl ester; 576170-42-8 |
| EINECS | Contact for details |
Quality Control
Our Benzoic Acid, 4-Methoxy-3-(Trifluoromethyl)-, Methyl Ester is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, GC, NMR, and mass spectrometry, to ensure high chemical purity and identity confirmation. Certificates of Analysis (COA) with detailed chromatographic data are provided for each lot to support your quality assurance and regulatory needs.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated place at room temperature (15-25°C). Keep away from heat, sparks, and open flame. The container should be kept tightly sealed in a dry environment to maintain product integrity.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white crystalline powder or solid |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Purity (HPLC) | ≥ 98.0% |
| Melting Point | Contact for details |
| Loss on Drying | ≤ 0.5% |
| Residue on Ignition | ≤ 0.1% |
| Heavy Metals | ≤ 10 ppm |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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Each batch undergoes strict QC, accompanied by COA, MSDS, and full compliance with international standards.
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