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tert-Butyl Hexahydro-1H-Pyrrolo[3,4-C]Pyridine-5(6H)-Carboxylate Hydrochloride CAS NO 1187933-06-7
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CAS No.:1187933-06-7
Grade:Pharmacy Grade
Content:99.9%
Brand:Customizable
Packaging:Customizable
Description
tert-Butyl Hexahydro-1H-Pyrrolo[3,4-C]Pyridine-5(6H)-Carboxylate Hydrochloride is a high-purity, protected heterocyclic amine building block essential for advanced pharmaceutical synthesis. This compound matters because it serves as a critical intermediate in the development of novel active pharmaceutical ingredients (APIs), particularly in central nervous system (CNS) and oncology research. Pharmaceutical R&D laboratories and fine chemical manufacturers need this material for constructing complex molecular scaffolds, enabling the creation of next-generation therapeutics with improved efficacy and selectivity.
Application
- Pharmaceutical Intermediate: A key synthon in the multi-step synthesis of complex drug candidates, especially those targeting neurological receptors.
- Medicinal Chemistry Research: Used as a versatile scaffold for constructing focused libraries in structure-activity relationship (SAR) studies.
- API Development: Serves as a protected precursor in the final stages of Active Pharmaceutical Ingredient (API) manufacturing for clinical trials and commercial production.
- Peptidomimetic Synthesis: Employed in the design and synthesis of peptide analogs and mimetics due to its constrained bicyclic structure.
- Ligand and Catalyst Preparation: Useful for creating chiral ligands and organocatalysts used in asymmetric synthesis.
- Chemical Biology Probes: Incorporated into molecular probes for studying enzyme function and biological pathways.
Basic Information
| Product Name | tert-Butyl Hexahydro-1H-Pyrrolo[3,4-C]Pyridine-5(6H)-Carboxylate Hydrochloride |
| CAS No. | 1187933-06-7 |
| Molecular Formula | C13H24N2O2·HCl |
| Molecular Weight | 276.80 g/mol (Free base: 240.34 g/mol) |
| Synonyms | tert-Butyl 1,3,3a,4,6,6a-Hexahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylate Hydrochloride; 1-Boc-3-azabicyclo[3.1.0]hexane-3-carboxylic Acid Hydrochloride (incorrect but common misnomer); 5-tert-Butoxycarbonyl-2,3,3a,4,5,6-hexahydro-1H-pyrrolo[3,4-c]pyridine Hydrochloride; 1,3,3a,4,6,6a-Hexahydro-1H-pyrrolo[3,4-c]pyridine-5-carboxylic Acid, 1,1-Dimethylethyl Ester, Hydrochloride; tert-Butyl Hexahydro-1H-Pyrrolo[3,4-C]Pyridine-5-Carboxylate HCl; Boc-Protected 3-Azabicyclo[3.1.0]hexane Hydrochloride Salt; CAS 1187933-06-7 |
| EINECS | Contact for details |
Quality Control
Our tert-Butyl Hexahydro-1H-Pyrrolo[3,4-C]Pyridine-5(6H)-Carboxylate Hydrochloride is manufactured under strict quality management systems to ensure batch-to-batch consistency for critical R&D and scale-up work. All batches undergo comprehensive analytical characterization using HPLC, NMR, and MS to confirm identity and purity. A detailed Certificate of Analysis (COA) is provided with each shipment, documenting compliance with agreed specifications. We support development under cGMP guidelines where required.
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 nature, the container must be kept tightly sealed in a dry environment to prevent moisture uptake, which can affect stability and handling properties. For long-term storage, consider using desiccants.
Specification
| Item | Specification |
|---|---|
| Appearance | White to off-white crystalline powder |
| Identification (IR) | Conforms to structure |
| Identification (NMR) | Conforms to structure |
| Assay (HPLC) | ≥ 98.0% |
| Purity (HPLC, Area %) | ≥ 99.0% |
| Water Content (KF) | ≤ 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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