Description

2,5-Diaza-Bicyclo[2.2.2]Octane-2-Carboxylic Acid Benzyl Ester is a sophisticated bicyclic amine derivative and a key protected intermediate in advanced organic synthesis. This compound matters for its role as a crucial building block in the development of complex pharmaceutical molecules, particularly those targeting neurological and oncological pathways. Professional researchers and process chemists in the pharmaceutical, agrochemical, and fine chemical industries need this high-purity intermediate to enable efficient and scalable synthetic routes.

Application

• Pharmaceutical Intermediate: A critical building block for the synthesis of novel active pharmaceutical ingredients (APIs), especially in central nervous system (CNS) and oncology drug discovery programs.
• Ligand and Catalyst Precursor: Used in the preparation of specialized ligands for asymmetric catalysis and metal-organic frameworks (MOFs).
• Peptidomimetic Chemistry: Serves as a constrained scaffold for designing and synthesizing peptidomimetics and protease inhibitors.
• Agrochemical Research: Employed in the development of new generation herbicides and pesticides with specific mode-of-action targets.
• Academic & R&D: A valuable reagent for methodological studies in organic chemistry and for exploring new chemical spaces in high-throughput screening libraries.
• Custom Synthesis: A starting point for contract research organizations (CROs) and CDMOs performing bespoke synthesis for client projects.

Basic Information

Product Name	2,5-Diaza-Bicyclo[2.2.2]Octane-2-Carboxylic Acid Benzyl Ester
CAS No.	956794-81-3
Molecular Formula	C14H18N2O2
Molecular Weight	246.31 g/mol
Synonyms	2,5-Diazabicyclo[2.2.2]octane-2-carboxylic acid phenylmethyl ester; Benzyl 2,5-diazabicyclo[2.2.2]octane-2-carboxylate; 1,4-Diazabicyclo[2.2.2]octane-2-carboxylic acid benzyl ester (common misnomer); DABCO-2-COOBn; 2-Carbobenzyloxy-2,5-diaza-bicyclo[2.2.2]octane; Bicyclo[2.2.2]diazacetane-2-carboxylate benzyl ester; 956794-81-3; 2,5-DABCO-2-COOBzl
EINECS	Contact for details

Quality Control

Our 2,5-Diaza-Bicyclo[2.2.2]Octane-2-Carboxylic Acid Benzyl Ester is produced under strict quality management systems. Each batch undergoes rigorous analytical testing, including HPLC, NMR, and mass spectrometry, to ensure high chemical purity and identity confirmation. We provide comprehensive Certificates of Analysis (COA) with each shipment, detailing all specified parameters. Our quality commitment supports compliance with cGMP and ICH guidelines for pharmaceutical intermediates, ensuring reliability for your critical R&D and scale-up processes.

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). This compound is moisture-sensitive (hygroscopic); keep the container tightly sealed under an inert atmosphere (e.g., nitrogen or argon) for long-term storage to prevent degradation.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Identification (NMR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
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.