Description

1H-Isoindole-1-Carbonitrile,Octahydro-,(1Alpha,3Abeta,7Abeta)-(9Ci) CAS NO 96798-42-4 is a high-purity, specialized organic compound belonging to the octahydroisoindole family, serving as a critical chiral building block in advanced chemical synthesis. Its value lies in its unique stereochemistry and functional groups, which enable the construction of complex molecular architectures with high precision. This product is essential for research and development chemists in the pharmaceutical and agrochemical industries, particularly for creating novel active ingredients and fine chemicals.

Application

• Pharmaceutical Intermediate: A key chiral synthon for the research and development of new active pharmaceutical ingredients (APIs), especially in central nervous system (CNS) and cardiovascular drug candidates.
• Agrochemical Synthesis: Used in the production of advanced pesticides and herbicides, where its structural framework contributes to biological activity and selectivity.
• Asymmetric Catalysis: Employed as a ligand precursor or a chiral auxiliary in catalytic reactions to induce stereoselectivity.
• Fine Chemical Production: Serves as a foundational block for synthesizing complex dyes, pigments, and other performance chemicals requiring specific stereochemistry.
• Academic & Industrial R&D: A valuable reagent for methodological development in organic chemistry, particularly in studies involving cyclization and nitrile chemistry.
• Material Science Research: Investigated for potential use in creating novel polymers or organic electronic materials with tailored properties.

Basic Information

Product Name	1H-Isoindole-1-Carbonitrile,Octahydro-,(1Alpha,3Abeta,7Abeta)-(9Ci)
CAS No.	96798-42-4
Molecular Formula	C9H14N2
Molecular Weight	150.22 g/mol
Synonyms	(1α,3aβ,7aβ)-Octahydro-1H-isoindole-1-carbonitrile; (1Alpha,3Abeta,7Abeta)-Octahydro-1H-isoindole-1-carbonitrile; 1-Cyanooctahydroisoindole; Octahydroisoindole-1-carbonitrile; 1H-Isoindole-1-carbonitrile, octahydro-, (1α,3aβ,7aβ)-; 96798-42-4; (1R,3aS,7aS)-1-Cyanooctahydro-1H-isoindole
EINECS	Contact for details

Quality Control

Our 1H-Isoindole-1-Carbonitrile,Octahydro-,(1Alpha,3Abeta,7Abeta)-(9Ci) is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including chiral purity analysis, to ensure it meets the high standards required for advanced synthetic applications. Certificates of Analysis (COA) detailing purity, identity, and impurity profiles are available upon request to support your quality assurance and regulatory needs.

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 (moisture-sensitive) nature, the container must be kept tightly sealed after each use to prevent degradation from atmospheric moisture. Keep away from incompatible materials.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Assay (HPLC)	≥ 98.0%
Chiral Purity (Chiral HPLC)	≥ 99.0% ee
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.