Description

Ethyl-1-Cyano-2-Methylcyclohexanecarboxylate is a versatile and high-purity chemical intermediate characterized by its unique cyclohexane ring structure functionalized with cyano and ester groups. This compound matters for its critical role as a building block in sophisticated organic synthesis, enabling the construction of complex molecules with precise stereochemistry. It is primarily needed by research and development chemists and process engineers in the pharmaceutical, agrochemical, and specialty chemical industries for creating active ingredients and advanced materials.

Application

• Pharmaceutical Intermediate: A key chiral synthon for the synthesis of novel active pharmaceutical ingredients (APIs), particularly in central nervous system (CNS) and cardiovascular drug discovery programs.
• Agrochemical Synthesis: Serves as a precursor in the manufacturing of advanced pesticides and herbicides, where its structural motifs contribute to biological activity.
• Fine Chemical Production: Used in the preparation of specialty chemicals, including liquid crystals, dyes, and performance additives.
• Academic & Industrial Research: A valuable reagent for methodological development in organic chemistry, including studies on cyclization reactions and asymmetric synthesis.
• Flavor & Fragrance Industry: Potential intermediate for the synthesis of complex aroma chemicals and musk analogs due to its ester functionality and cyclic structure.

Basic Information

Product Name	Ethyl-1-Cyano-2-Methylcyclohexanecarboxylate
CAS No.	5231-79-8
Molecular Formula	C11H17NO2
Molecular Weight	195.26 g/mol
Synonyms	Ethyl 1-Cyano-2-methylcyclohexanecarboxylate; 1-Cyano-2-methylcyclohexanecarboxylic Acid Ethyl Ester; 2-Methyl-1-cyanocyclohexanecarboxylic Acid Ethyl Ester; Ethyl 2-Methyl-1-cyanocyclohexanecarboxylate; 5231-79-8; NSC 163045
EINECS	Contact for details

Quality Control

Our Ethyl-1-Cyano-2-Methylcyclohexanecarboxylate is manufactured under strict quality management systems. Each batch undergoes rigorous analytical testing, including chromatography (HPLC/GC) and spectroscopic methods (NMR, IR), to ensure identity, purity, and consistency. We provide comprehensive Certificates of Analysis (COA) with every shipment, detailing all specified parameters. Our quality commitment aligns with cGMP principles where applicable, supporting our customers' regulatory and research needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at controlled room temperature (15-25°C). Keep away from strong acids and incompatible materials such as strong oxidizing agents. The container should be kept tightly sealed to prevent moisture absorption and potential degradation.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
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.