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3-Fluoro-4-Nitrobenzotrifluoride CAS NO 402-12-0
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CAS No.:402-12-0
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
3-Fluoro-4-Nitrobenzotrifluoride is a versatile fluorinated aromatic building block of significant importance in advanced organic synthesis. Its unique structure, featuring both a nitro and a trifluoromethyl group on a fluorinated benzene ring, makes it a critical intermediate for constructing complex molecules. This compound is primarily sought after by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for the development of new active ingredients.
Application
- Pharmaceutical Intermediate: A key precursor in the synthesis of novel active pharmaceutical ingredients (APIs), particularly those requiring fluorinated aromatic scaffolds for enhanced metabolic stability and bioavailability.
- Agrochemical Synthesis: Used in the research and production of advanced herbicides, fungicides, and insecticides, where the trifluoromethyl group often contributes to improved efficacy and environmental profile.
- Liquid Crystal & OLED Material Development: Serves as a building block for fluorinated components in electronic display materials and organic light-emitting diodes (OLEDs).
- Dye & Pigment Intermediate: Employed in the synthesis of specialized dyes and pigments, where the nitro group can be further functionalized.
- Cross-Coupling Reactions: Acts as a substrate in palladium-catalyzed cross-coupling reactions (e.g., Suzuki, Buchwald-Hartwig) to create complex biaryl structures.
- Nucleophilic Aromatic Substitution: The nitro and fluorine groups make it an excellent substrate for nucleophilic aromatic substitution reactions, enabling the introduction of various amines and alkoxides.
Basic Information
| Product Name | 3-Fluoro-4-Nitrobenzotrifluoride |
| CAS No. | 402-12-0 |
| Molecular Formula | C7H3F4NO2 |
| Molecular Weight | 209.10 g/mol |
| Synonyms | 1-Fluoro-2-nitro-4-(trifluoromethyl)benzene; 4-Nitro-3-fluorobenzotrifluoride; 2-Nitro-α,α,α-trifluoro-p-fluorotoluene; Benzene, 1-fluoro-2-nitro-4-(trifluoromethyl)-; α,α,α-Trifluoro-4-fluoro-3-nitrotoluene; 3-Fluoro-4-nitro-α,α,α-trifluorotoluene; p-Fluoro-m-nitrobenzotrifluoride |
| EINECS | 206-933-5 |
Quality Control
Our 3-Fluoro-4-Nitrobenzotrifluoride is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing to ensure high purity and consistency, meeting the exacting standards required for research and scale-up applications. A comprehensive Certificate of Analysis (COA) detailing purity, identity, and impurity profiles is provided with each shipment to guarantee traceability and support your regulatory needs.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated area at room temperature (15-25°C). Keep away from heat, sparks, and open flame. The container should be kept tightly closed when not in use to prevent contamination and moisture absorption.
Specification
| Item | Specification |
|---|---|
| Appearance | Yellow to light brown crystalline powder or solid |
| Identification (IR) | Conforms to structure |
| Purity (HPLC) | ≥ 98.0% |
| Melting Point | Contact for details |
| Water Content (KF) | ≤ 0.5% |
| Residue on Ignition | ≤ 0.1% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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