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5H-1,3-Dioxolo4,5-cpyrrole-5-carboxylic acid, 4-(1,1-dimethylethyl)dimethylsilyloxymethyltetrahydro-2,2-dimethyl-6-(3-nitrophenyl)-, 1,1-dimethylethyl ester, (3aR,4R,6S,6aS)- CAS NO 188744-93-6
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CAS No.:188744-93-6
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
5H-1,3-Dioxolo4,5-cpyrrole-5-carboxylic acid, 4-(1,1-dimethylethyl)dimethylsilyloxymethyltetrahydro-2,2-dimethyl-6-(3-nitrophenyl)-, 1,1-dimethylethyl ester, (3aR,4R,6S,6aS)- is a sophisticated, stereochemically defined synthetic intermediate of significant value in advanced organic synthesis. This compound matters because its complex molecular architecture, featuring a protected carboxylic acid group and a nitrophenyl moiety, makes it a critical building block for constructing more complex pharmacologically active molecules. Pharmaceutical research and development organizations need this high-purity intermediate for the synthesis of novel active pharmaceutical ingredients (APIs) and for use in medicinal chemistry programs.
Application
- Pharmaceutical Intermediate: Serves as a key chiral building block in the multi-step synthesis of potential drug candidates, particularly in central nervous system (CNS) and oncology research.
- Medicinal Chemistry: Used in structure-activity relationship (SAR) studies and lead optimization processes due to its modifiable functional groups.
- Process Chemistry Development: Employed in scaling up synthetic routes from laboratory to pilot plant scale for new chemical entities (NCEs).
- Custom Synthesis: A starting material for contract research and manufacturing organizations (CRMOs) producing specialized compounds for clients.
- Academic Research: Utilized in university and institutional labs for developing new synthetic methodologies involving complex heterocycles and protecting group strategies.
- Reference Standard: Can be supplied as a high-purity analytical standard for quality control and method development in API manufacturing.
Basic Information
| Item | Details |
|---|---|
| Product Name | 5H-1,3-Dioxolo4,5-cpyrrole-5-carboxylic acid, 4-(1,1-dimethylethyl)dimethylsilyloxymethyltetrahydro-2,2-dimethyl-6-(3-nitrophenyl)-, 1,1-dimethylethyl ester, (3aR,4R,6S,6aS)- |
| CAS No. | 188744-93-6 |
| Molecular Formula | C26H39NO7Si |
| Molecular Weight | 505.69 g/mol |
| Synonyms | (3aR,4R,6S,6aS)-4-[(tert-Butyldimethylsilyloxy)methyl]-2,2-dimethyl-6-(3-nitrophenyl)tetrahydro-5H-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylic acid tert-butyl ester; tert-Butyl (3aR,4R,6S,6aS)-4-((tert-butyldimethylsilyloxy)methyl)-2,2-dimethyl-6-(3-nitrophenyl)tetrahydro-5H-[1,3]dioxolo[4,5-c]pyrrole-5-carboxylate; 5H-[1,3]Dioxolo[4,5-c]pyrrole-5-carboxylic acid, 4-[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]tetrahydro-2,2-dimethyl-6-(3-nitrophenyl)-, 1,1-dimethylethyl ester, (3aR,4R,6S,6aS)-; TBS-protected pyrrolidine dioxolane carboxylate nitroarene intermediate. |
| EINECS | Contact for details |
Quality Control
Our 5H-1,3-Dioxolo4,5-cpyrrole-5-carboxylic acid tert-butyl ester intermediate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including chiral purity verification, to ensure it meets the exacting standards required for pharmaceutical R&D. Certificates of Analysis (COA) detailing identity, purity, and impurity profiles are provided and can be tailored to meet specific client requirements or internal specifications.
Storage
Preserve in a tightly closed container, protected from light. Store in a cool, dry place at a controlled room temperature (15-25°C). This product is hygroscopic (moisture-sensitive) and should be handled under anhydrous conditions to maintain stability. Keep away from strong bases and incompatible organic solvents.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white solid |
| Identification (IR) | Conforms to structure |
| Assay (HPLC) | ≥ 97.0% |
| Chiral Purity (Chiral HPLC) | ≥ 99.0% ee |
| Related Substances (HPLC) | Total impurities ≤ 2.0% Any single impurity ≤ 0.5% |
| Residual Solvents (GC) | Meets ICH Q3C guidelines |
| Water Content (KF) | ≤ 0.5% |
Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.
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