Description

(1α,2β,4β,5α)-6β-Chloro-3,8-Dioxatricyclo[3.2.1.02,4]Octane-6-Carbonitrile is a specialized bicyclic nitrile compound featuring a unique chloro-substituted dioxatricyclo[3.2.1.02,4]octane core structure. This compound matters as a high-value chemical intermediate and building block for the synthesis of complex molecules, particularly in advanced pharmaceutical and agrochemical research. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical, crop protection, and fine chemical industries seeking to introduce novel stereochemistry and functional groups into their target compounds.

Application

• Pharmaceutical Intermediate: A key chiral building block for the synthesis of novel active pharmaceutical ingredients (APIs), especially in central nervous system (CNS) and antiviral drug discovery.
• Agrochemical Synthesis: Used in the research and development of advanced herbicides, fungicides, and insecticides, leveraging its rigid, oxygenated bicyclic structure.
• Ligand and Catalyst Development: Serves as a precursor for creating novel chiral ligands and organocatalysts used in asymmetric synthesis.
• Material Science Research: Investigated as a monomer or cross-linking agent for developing polymers with specific thermal or mechanical properties.
• Academic & Industrial R&D: Employed in methodological studies and the construction of complex natural product analogs and molecular scaffolds.

Basic Information

Product Name	(1α,2β,4β,5α)-6β-Chloro-3,8-Dioxatricyclo[3.2.1.02,4]Octane-6-Carbonitrile
CAS No.	81763-40-8
Molecular Formula	C8H8ClNO2
Molecular Weight	185.61 g/mol
Synonyms	6β-Chloro-3,8-dioxatricyclo[3.2.1.02,4]octane-6-carbonitrile; (1a,2b,4b,5a)-6b-Chloro-3,8-dioxatricyclo[3.2.1.02,4]octane-6-carbonitrile; 6-Chloro-3,8-dioxatricyclo[3.2.1.02,4]octane-6-carbonitrile; Tricyclic Chloro Nitrile; Bicyclic Chloro Dioxane Carbonitrile; 81763-40-8; (1alpha,2beta,4beta,5alpha)-6beta-Chloro-3,8-dioxatricyclo[3.2.1.02,4]octane-6-carbonitrile
EINECS	Contact for details

Quality Control

Our (1α,2β,4β,5α)-6β-Chloro-3,8-Dioxatricyclo[3.2.1.02,4]Octane-6-Carbonitrile is produced under strict quality management systems. Every batch undergoes rigorous analytical testing, including HPLC for purity and chiral analysis to confirm stereochemical integrity, ensuring compliance with research-grade specifications. A comprehensive Certificate of Analysis (COA) detailing identity, purity, and impurity profile is provided with each shipment to guarantee batch-to-batch consistency and support your regulatory documentation.

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 in a dry environment to minimize exposure to moisture. Store away from incompatible materials such as strong bases and strong oxidizing agents.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 97.0%
Chiral Purity (Chiral HPLC)	≥ 98.0% ee
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.