Description

2-Azabicyclo[2.1.1]Hexane-1-Carbonitrile,2-(1,1-Dimethylethyl)-(9Ci) is a high-purity, advanced pharmaceutical intermediate featuring a unique bridged bicyclic nitrile structure. This compound is of significant value for enabling novel synthetic routes in medicinal chemistry, particularly for the development of conformationally constrained bioactive molecules. It is primarily sought by R&D chemists and process development scientists in the pharmaceutical and biotechnology sectors for the synthesis of new chemical entities and active pharmaceutical ingredients (APIs).

Application

• Pharmaceutical Intermediate: A key building block for the synthesis of novel drug candidates, especially those targeting the central nervous system (CNS) and other therapeutic areas.
• Medicinal Chemistry Research: Used in lead optimization and structure-activity relationship (SAR) studies to introduce steric bulk and conformational rigidity into molecular scaffolds.
• Process Chemistry Development: Serves as a starting material or intermediate in the scale-up and optimization of synthetic routes for potential APIs.
• Chemical Biology Probes: Utilized in the design and synthesis of specialized molecular probes for studying enzyme function or protein-ligand interactions.
• Agrochemical Research: Potential intermediate for developing new crop protection agents with novel modes of action.
• Academic & Institutional R&D: Employed in university and research institute laboratories for methodological studies and the exploration of new heterocyclic chemistry.

Basic Information

Item	Detail
Product Name	2-Azabicyclo[2.1.1]Hexane-1-Carbonitrile,2-(1,1-Dimethylethyl)-(9Ci)
CAS No.	463961-52-6
Molecular Formula	C10H16N2
Molecular Weight	164.25 g/mol
Synonyms	2-tert-Butyl-2-azabicyclo[2.1.1]hexane-1-carbonitrile; 2-(tert-Butyl)-2-azabicyclo[2.1.1]hexane-1-carbonitrile; 2-Azabicyclo[2.1.1]hexane-1-carbonitrile, 2-(1,1-dimethylethyl)-; 2-(tert-Butyl)-2-azabicyclo[2.1.1]hexane-1-carbonitrile; 463961-52-6; tert-Butyl 2-azabicyclo[2.1.1]hexane-1-carbonitrile
EINECS	Contact for details

Quality Control

Our 2-Azabicyclo[2.1.1]Hexane-1-Carbonitrile,2-(1,1-Dimethylethyl)-(9Ci) is manufactured under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC, GC, NMR, and MS, to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all critical quality attributes. Our commitment to cGMP principles and compliance with ICH Q7 guidelines ensures material integrity for demanding pharmaceutical applications.

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 the container tightly sealed to prevent moisture absorption and potential degradation. Store away from incompatible materials such as strong oxidizing agents.

Specification

Item	Specification
Appearance	White to off-white solid
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Water Content (KF)	≤ 0.5%
Residue on Ignition	≤ 0.1%

Note: Specifications can be tailored. Please contact us for the detailed technical data sheet of a specific grade.