Description

Bicyclo[2.2.2]Oct-2-Ene, 5-(1-Methylethyl)-, (1Alpha,4Alpha,5Ba)- (9Ci) is a specialized bicyclic organic compound with a unique, rigid molecular framework. This structure makes it a valuable and versatile intermediate in advanced organic synthesis, particularly for constructing complex, three-dimensional molecular architectures. It is primarily sought after by research chemists and process development scientists in the pharmaceutical and agrochemical industries for applications in medicinal chemistry and material science.

Application

• Pharmaceutical Intermediate: Serves as a key chiral building block for the synthesis of novel active pharmaceutical ingredients (APIs), especially those requiring rigid, three-dimensional scaffolds to enhance binding affinity and selectivity.
• Agrochemical Synthesis: Used in the research and development of new pesticides and herbicides, where its bicyclic structure can contribute to improved stability and biological activity.
• Material Science Research: Acts as a precursor for developing specialty polymers, ligands, or organic frameworks with specific mechanical or electronic properties.
• Asymmetric Catalysis: Employed in the synthesis of chiral ligands or organocatalysts due to its inherent stereochemistry defined by the (1Alpha,4Alpha,5Ba) configuration.
• Academic & Industrial R&D: A crucial reagent for methodological studies in organic chemistry, including Diels-Alder reactions and other cycloadditions to explore new synthetic pathways.
• Fine Chemical Production: Utilized in the multi-step synthesis of complex fragrance compounds, flavors, or other high-value specialty chemicals.

Basic Information

Product Name	Bicyclo[2.2.2]Oct-2-Ene, 5-(1-Methylethyl)-, (1Alpha,4Alpha,5Ba)- (9Ci)
CAS No.	106562-31-6
Molecular Formula	C11H18
Molecular Weight	150.26 g/mol
Synonyms	5-Isopropylbicyclo[2.2.2]oct-2-ene; (1α,4α,5β)-5-(1-Methylethyl)bicyclo[2.2.2]oct-2-ene; 5-Isopropyl-2,5-norbornadiene (related common name); 5-(Propan-2-yl)bicyclo[2.2.2]oct-2-ene; Bicyclo[2.2.2]oct-2-ene, 5-isopropyl-; (1R,4R,5S)-5-Isopropylbicyclo[2.2.2]oct-2-ene (stereoisomer); Bicyclic terpene derivative
EINECS	Contact for details

Quality Control

Our Bicyclo[2.2.2]Oct-2-Ene, 5-(1-Methylethyl)-, (1Alpha,4Alpha,5Ba)- (9Ci) is produced and handled under a strict quality management system. Each batch undergoes comprehensive analytical testing to ensure identity, purity, and consistency. Certificates of Analysis (COA) detailing specifications such as assay (by GC or HPLC), enantiomeric excess (if applicable), and impurity profiles are provided and available upon request to support your regulatory and R&D documentation needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area. For long-term storage, maintaining the material at 2-8°C under an inert atmosphere (e.g., nitrogen or argon) is recommended to preserve stability and prevent potential degradation.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Assay (GC)	≥ 95.0%
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.