Description

2,4,6-Cycloheptatriene-1-Carbonitrile,1-(1-Methylethyl)-(9Ci) is a specialized organic intermediate featuring a cycloheptatriene core with a nitrile and an isopropyl substituent. This compound matters for its unique structural framework, which is valuable in advanced synthetic chemistry for constructing complex molecular architectures. It is primarily needed by R&D chemists and process development scientists in the pharmaceutical and agrochemical industries for applications in ligand synthesis, catalyst development, and the preparation of novel active ingredients.

Application

• Pharmaceutical Intermediate: Serves as a key building block in the synthesis of novel drug candidates and active pharmaceutical ingredients (APIs).
• Agrochemical Research: Used in the development of new herbicides, fungicides, and insecticides requiring complex cyclic structures.
• Ligand and Catalyst Synthesis: Acts as a precursor for creating specialized ligands used in transition metal catalysis and asymmetric synthesis.
• Material Science Research: Investigated as a monomer or additive for developing advanced polymers with specific electronic or optical properties.
• Organic Synthesis: Employed in Diels-Alder reactions and other cycloadditions due to its conjugated triene system.
• Fine Chemical Production: Utilized in the multi-step synthesis of high-value, low-volume specialty chemicals.

Basic Information

Product Name	2,4,6-Cycloheptatriene-1-Carbonitrile,1-(1-Methylethyl)-(9Ci)
CAS No.	79574-42-8
Molecular Formula	C11H13N
Molecular Weight	159.23 g/mol
Synonyms	1-Isopropyl-2,4,6-cycloheptatriene-1-carbonitrile; 1-(1-Methylethyl)-2,4,6-cycloheptatriene-1-carbonitrile; 1-Isopropylcyclohepta-2,4,6-trien-1-carbonitrile; 79574-42-8; (1-Isopropylcyclohepta-2,4,6-trien-1-yl)carbonitrile; Tropylium derivative nitrile
EINECS	Contact for details

Quality Control

Our 2,4,6-Cycloheptatriene-1-Carbonitrile,1-(1-Methylethyl)-(9Ci) is produced under strict quality management protocols. Each batch undergoes rigorous analytical testing, including HPLC, GC, and NMR, to ensure high purity and consistency. Certificates of Analysis (COA) detailing identity, purity, and impurity profiles are provided with every shipment to support your quality assurance and regulatory needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, well-ventilated place at room temperature (15-25°C). Keep away from incompatible materials such as strong acids and oxidizing agents. For long-term storage, consider maintaining under an inert atmosphere to preserve stability.

Specification

Item	Specification
Appearance	Colorless to pale yellow liquid or solid
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 95.0%
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.