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(2R,3S)-Methyl 2-(2-Bromophenyl)-3-(Trifluoromethyl)-1,4-Oxathiane-3-Carboxylate CAS NO 876156-56-8
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CAS No.:876156-56-8
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
(2R,3S)-Methyl 2-(2-Bromophenyl)-3-(Trifluoromethyl)-1,4-Oxathiane-3-Carboxylate is a high-value, stereochemically defined chiral building block featuring a unique oxathiane heterocycle. This compound is engineered to provide a rigid, functionalized scaffold critical for the synthesis of complex molecules, particularly in advanced pharmaceutical research. It is primarily sought after by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for constructing novel active ingredients with specific three-dimensional architectures.
Application
- Pharmaceutical Intermediate: A key chiral synthon for the development of new drug candidates, especially in areas targeting central nervous system (CNS) disorders, antiviral agents, and enzyme inhibitors.
- Agrochemical Research: Used in the synthesis of novel, stereoselective pesticides and herbicides where the specific spatial arrangement of the bromophenyl and trifluoromethyl groups is crucial for bioactivity.
- Ligand and Catalyst Development: Serves as a precursor for creating chiral ligands and organocatalysts used in asymmetric synthesis to control stereochemistry in chemical reactions.
- Material Science Research: Investigated as a monomer or functional additive for creating specialty polymers with unique optical or electronic properties.
- Academic & Contract Research: Employed in university and CRO laboratories for methodological studies in heterocyclic and fluorine chemistry.
Basic Information
| Item | Details |
|---|---|
| Product Name | (2R,3S)-Methyl 2-(2-Bromophenyl)-3-(Trifluoromethyl)-1,4-Oxathiane-3-Carboxylate |
| CAS No. | 876156-56-8 |
| Molecular Formula | C14H12BrF3O3S |
| Molecular Weight | 397.21 g/mol |
| Synonyms | Methyl (2R,3S)-2-(2-bromophenyl)-3-(trifluoromethyl)-1,4-oxathiane-3-carboxylate; (2R,3S)-Methyl 2-(o-bromophenyl)-3-(trifluoromethyl)-1,4-oxathiane-3-carboxylate; (2R,3S)-2-(2-Bromophenyl)-3-(trifluoromethyl)-1,4-oxathiane-3-carboxylic acid methyl ester; CAS 876156-56-8; Chiral oxathiane carboxylate ester; 1,4-Oxathiane-3-carboxylic acid, 2-(2-bromophenyl)-3-(trifluoromethyl)-, methyl ester, (2R,3S)- |
| EINECS | Contact for details |
Quality Control
Every batch of (2R,3S)-Methyl 2-(2-Bromophenyl)-3-(Trifluoromethyl)-1,4-Oxathiane-3-Carboxylate is produced and tested under strict quality management systems. We ensure high chiral purity and chemical integrity through advanced analytical techniques. A comprehensive Certificate of Analysis (COA) detailing identity, purity, enantiomeric excess, and impurity profiles is provided with each shipment to support your regulatory and R&D documentation needs.
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). Keep away from strong bases and incompatible organic solvents. For long-term storage under inert atmosphere, please contact our technical team for specific recommendations.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white crystalline powder |
| Identification (IR) | Conforms to structure |
| Identification (HPLC) | Conforms to reference |
| Assay (HPLC) | ≥ 97.0% |
| Enantiomeric Excess (Chiral HPLC) | ≥ 99.0% |
| Loss on Drying | ≤ 0.5% |
| Residue on Ignition | ≤ 0.1% |
| 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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