Description

3-(4-Isopropylphenyl)-3-Oxopropanenitrile is a specialized organic intermediate featuring a β-ketonitrile functional group attached to an isopropyl-substituted aromatic ring. This unique molecular structure makes it a valuable building block for synthesizing more complex chemical entities, particularly in the pharmaceutical and agrochemical sectors. It is primarily sought after by research and development chemists and process engineers involved in the production of active pharmaceutical ingredients (APIs), fine chemicals, and advanced materials.

Application

• Pharmaceutical Intermediate: A key precursor in the synthesis of novel drug candidates, particularly those targeting central nervous system (CNS) disorders, inflammation, and metabolic diseases.
• Agrochemical Synthesis: Used in the development of advanced herbicides, fungicides, and plant growth regulators, leveraging its aromatic ketone functionality.
• Fine Chemical Production: Serves as a versatile synthon for constructing heterocyclic compounds, such as pyrazoles and isoxazoles, which are prevalent in various specialty chemicals.
• Material Science Research: Investigated as a monomer or cross-linking agent in the development of polymers with specific optical or electronic properties.
• Organic Synthesis Research: Employed in academic and industrial R&D for methodologies involving cyanoacetophenone derivatives, such as Knoevenagel condensations and Michael additions.

Basic Information

Product Name	3-(4-Isopropylphenyl)-3-Oxopropanenitrile
CAS No.	199102-70-0
Molecular Formula	C12H13NO
Molecular Weight	187.24 g/mol
Synonyms	4'-Isopropyl-3-oxobutanenitrile; 3-Oxo-3-(4-isopropylphenyl)propanenitrile; 4-Isopropylbenzoylacetonitrile; 3-(4-Isopropylphenyl)-3-oxopropionitrile; 1-(4-Isopropylphenyl)-2-cyanoethanone; β-Oxo-4-isopropylbenzenepropanenitrile; p-Isopropylbenzoylacetonitrile; 199102-70-0
EINECS	Contact for details

Quality Control

Our production of 3-(4-Isopropylphenyl)-3-Oxopropanenitrile adheres to stringent quality management protocols to ensure batch-to-batch consistency and high purity. Each lot is analyzed using advanced chromatographic and spectroscopic techniques. A comprehensive Certificate of Analysis (COA) detailing purity, identity, and impurity profiles is provided with every shipment to support your quality assurance and regulatory compliance needs.

Storage

Preserve in a tightly closed container, protected from light. Store in a cool, dry, and well-ventilated area at a controlled room temperature (typically 15-25°C). Keep away from strong oxidizing agents, strong bases, and sources of ignition.

Specification

Item	Specification
Appearance	White to off-white crystalline powder
Identification (IR)	Conforms to structure
Purity (HPLC)	≥ 98.0%
Melting Point	Contact for details
Loss on Drying	≤ 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.