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2-Bromo-4-[(Trifluoromethyl)Sulphanyl]Aniline, 4-Amino-3-Bromophenyl Trifluoromethyl Sulphide CAS NO 940077-66-7
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CAS No.:940077-66-7
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
2-Bromo-4-[(trifluoromethyl)sulphanyl]aniline, also known as 4-amino-3-bromophenyl trifluoromethyl sulphide, is a high-value, multifunctional aromatic amine building block. Its molecular structure, featuring both a reactive amino group and a stable, lipophilic trifluoromethylthio (SCF₃) moiety, makes it a critical intermediate for synthesizing advanced materials and bioactive compounds. This compound is primarily sought by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for creating novel molecules with enhanced properties.
Application
- Pharmaceutical Intermediate: A key synthon for the development of active pharmaceutical ingredients (APIs), particularly those targeting central nervous system (CNS) disorders, inflammation, and infectious diseases, where the SCF₃ group can improve metabolic stability and membrane permeability.
- Agrochemical Synthesis: Used in the research and production of next-generation herbicides, fungicides, and insecticides, where the bromine and amino groups allow for further functionalization to create compounds with specific modes of action.
- Material Science Precursor: Serves as a monomer or functionalizing agent in the synthesis of specialty polymers, liquid crystals, and organic electronic materials, leveraging the unique electronic properties of the trifluoromethylthio group.
- Chemical Biology Probe Development: Employed in medicinal chemistry to create molecular probes and labeled compounds for studying biological pathways and target engagement, thanks to its versatile reactivity.
- Cross-Coupling Reactions: The bromine substituent makes it an excellent substrate for palladium-catalyzed cross-coupling reactions (e.g., Suzuki, Sonogashira), enabling rapid diversification of chemical libraries.
Basic Information
| Item | Details |
|---|---|
| Product Name | 2-Bromo-4-[(trifluoromethyl)sulphanyl]aniline |
| CAS No. | 940077-66-7 |
| Molecular Formula | C7H5BrF3NS |
| Molecular Weight | 272.09 g/mol |
| Synonyms | 4-Amino-3-bromophenyl trifluoromethyl sulphide; 3-Bromo-4-aminophenyl trifluoromethyl sulfide; 2-Bromo-4-(trifluoromethylthio)aniline; 4-Amino-3-bromo-α,α,α-trifluorothioanisole; 940077-66-7; Benzenamine, 2-bromo-4-[(trifluoromethyl)thio]-; 2-Bromo-4-(trifluoromethylsulfanyl)aniline |
| EINECS | Contact for details |
Quality Control
Every batch of 2-Bromo-4-[(trifluoromethyl)sulphanyl]aniline is manufactured and tested under a strict quality management system. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing key parameters such as purity (by HPLC), identity confirmation (by IR and NMR), and impurity profiles. Our quality commitment ensures the material meets the stringent requirements for research and scale-up applications in regulated industries.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated place at a controlled room temperature (15-25°C). Due to its hygroscopic (moisture-sensitive) nature, the container must be kept sealed under an inert atmosphere (e.g., nitrogen or argon) after opening to prevent degradation.
Specification
| Item | Specification |
|---|---|
| Appearance | Off-white to light yellow crystalline powder |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Purity (HPLC) | ≥ 97.0% |
| Melting Point | Contact for details |
| Loss on Drying | ≤ 1.0% |
| Heavy Metals | ≤ 20 ppm |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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