Cas no 2167561-87-5 (3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester)

3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester is a specialized pyrrolidine derivative with a cyclopropyl substituent at the 4-position and a tert-butyl ester group. This compound is valuable in organic synthesis and pharmaceutical research due to its sterically hindered ester moiety, which enhances stability and selectivity in reactions. The cyclopropyl group introduces conformational rigidity, potentially influencing biological activity or binding interactions. The tert-butyl ester serves as a protecting group for carboxylic acids, enabling controlled deprotection under mild conditions. Its structural features make it a useful intermediate for constructing complex molecules, particularly in medicinal chemistry and peptidomimetic design.
3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester structure
2167561-87-5 structure
Product Name:3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester
CAS No:2167561-87-5
MF:C12H21NO2
MW:211.30064368248
CID:5260745
Update Time:2025-05-21

3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester Chemical and Physical Properties

Names and Identifiers

    • 3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester
    • Inchi: 1S/C12H21NO2/c1-12(2,3)15-11(14)10-7-13-6-9(10)8-4-5-8/h8-10,13H,4-7H2,1-3H3
    • InChI Key: BLGXXHUWLGPVMB-UHFFFAOYSA-N
    • SMILES: N1CC(C2CC2)C(C(OC(C)(C)C)=O)C1

3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester Pricemore >>

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Additional information on 3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester

Comprehensive Overview of 3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester (CAS No. 2167561-87-5)

The compound 3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester (CAS No. 2167561-87-5) is a specialized organic molecule with significant potential in pharmaceutical and agrochemical research. Its unique structure, featuring a pyrrolidine core substituted with a cyclopropyl group and protected by a tert-butyl ester, makes it a valuable intermediate in synthetic chemistry. Researchers and industry professionals are increasingly interested in this compound due to its versatility in drug discovery and its role in modulating biological activity.

In recent years, the demand for pyrrolidine derivatives has surged, driven by their applications in designing protease inhibitors, receptor modulators, and other bioactive molecules. The 4-cyclopropyl substitution in this compound enhances its steric and electronic properties, which can influence binding affinity and metabolic stability. This aligns with current trends in medicinal chemistry, where fine-tuning molecular scaffolds is critical for optimizing drug candidates. Searches for "pyrrolidine-based building blocks" and "cyclopropyl-modified esters" have spiked, reflecting the growing interest in such compounds.

The tert-butyl ester group in CAS No. 2167561-87-5 serves as a protective moiety, enabling selective deprotection during multi-step syntheses. This feature is particularly valuable in peptide mimetics and fragment-based drug design, where controlled reactivity is essential. Laboratories focusing on "protecting group strategies" or "ester hydrolysis optimization" often explore derivatives like this for their synthetic flexibility. Additionally, the compound's stability under various conditions makes it suitable for high-throughput screening and combinatorial chemistry.

From an industrial perspective, 3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester is gaining attention for its scalability and compatibility with green chemistry principles. Manufacturers are investigating solvent-free reactions and catalytic methods to produce such intermediates sustainably. Queries like "eco-friendly synthesis of pyrrolidine esters" and "cost-effective chiral intermediates" highlight the market's focus on efficiency and environmental impact. This compound's potential extends to agrochemicals, where its structural motifs may contribute to novel herbicides or growth regulators.

Analytical characterization of CAS No. 2167561-87-5 typically involves advanced techniques such as NMR, HPLC-MS, and X-ray crystallography to confirm purity and stereochemistry. The rise of "structure-activity relationship (SAR) studies" and "computational modeling of small molecules" underscores the need for well-defined intermediates like this. Its spectral data and physicochemical properties are crucial for researchers validating synthetic routes or designing analogs with improved pharmacokinetic profiles.

In summary, 3-Pyrrolidinecarboxylic acid, 4-cyclopropyl-, 1,1-dimethylethyl ester represents a convergence of synthetic utility and biological relevance. Its applications span early-stage drug development to process chemistry, addressing contemporary challenges in molecular design. As interest in "tailored heterocyclic compounds" and "next-generation pharmaceutical intermediates" grows, this compound is poised to play a pivotal role in advancing chemical innovation.

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