104-47-2 | 4-Methoxyphenylacetonitrile

Packsize	Purity	Availability	Price	Discounted Price
25g	98%	in stock	$6.00	$5.00
100g	98%	in stock	$20.00	$14.00

Description

• Catalog Number: AB67876
• Chemical Name: 4-Methoxyphenylacetonitrile
• CAS Number: 104-47-2
• Molecular Formula: C9H9NO
• Molecular Weight: 147.17386
• MDL Number: MFCD00001919
• SMILES: COc1ccc(cc1)CC#N
• NSC Number: 96

Computed Properties

• Complexity: 150
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• XLogP3: 1.6

Upstream Synthesis Route

4-Methoxyphenylacetonitrile, also known as p-anisylacetonitrile, is a versatile chemical compound widely used in chemical synthesis as a key intermediate. Its unique molecular structure and properties make it a valuable building block in the creation of various pharmaceuticals, agrochemicals, and specialty chemicals.In chemical synthesis, 4-Methoxyphenylacetonitrile serves as a crucial precursor in the production of complex organic molecules. Its nitrile functional group enables it to participate in a variety of important reactions, such as nucleophilic addition, Grignard reactions, and cyanation processes. By undergoing these transformations, it can be further modified to introduce specific functional groups or structural motifs that are essential for the synthesis of target compounds.One of the primary applications of 4-Methoxyphenylacetonitrile is in the synthesis of pharmaceutical intermediates. Its ability to form versatile chemical bonds makes it a valuable tool in the development of new drug candidates and active pharmaceutical ingredients (APIs). Additionally, this compound is utilized in the creation of agrochemicals, enabling the production of crop protection agents and pesticides that play a crucial role in modern agriculture.Moreover, 4-Methoxyphenylacetonitrile finds use in the preparation of specialty chemicals and fine chemicals with diverse applications. Its favorable reactivity and functional group compatibility make it a desirable substrate for synthetic chemists seeking to build complex molecular structures efficiently. By leveraging the unique properties of this compound, researchers and industrial chemists can access a wide range of chemical transformations to tailor the properties of the final products.Overall, 4-Methoxyphenylacetonitrile plays a vital role in chemical synthesis by serving as a versatile and adaptable building block for the creation of valuable compounds across various industries. Its utility in pharmaceutical, agrochemical, and specialty chemical applications underscores its significance as a key intermediate in modern synthetic chemistry processes.

Literature

• Activity of meadowfoam (Limnanthes alba) seed meal glucolimnanthin degradation products against soilborne pathogens.

  Journal of agricultural and food chemistry 20120111

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101

• Sinapis phylogeny and evolution of glucosinolates and specific nitrile degrading enzymes.

  Phytochemistry 20081201

• Biotransformation of p-methoxyphenylacetonitrile into p-methoxyphenylacetic acid by resting cells of Bacillus subtilis.

  Biotechnology and applied biochemistry 20080701