1443-80-7 | 4-Acetylbenzonitrile

Packsize	Purity	Availability	Price	Discounted Price
5g	98%	in stock	$6.00	$5.00
10g	98%	in stock	$10.00	$7.00
25g	98%	in stock	$21.00	$15.00

Description

• Catalog Number: AA71454
• Chemical Name: 4-Acetylbenzonitrile
• CAS Number: 1443-80-7
• Molecular Formula: C9H7NO
• Molecular Weight: 145.15798000000004
• MDL Number: MFCD00001825
• SMILES: N#Cc1ccc(cc1)C(=O)C

Computed Properties

• Complexity: 193
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• XLogP3: 1.2

Upstream Synthesis Route

Benzonitrile, 4-acetyl- is a versatile compound commonly used in chemical synthesis applications. Its main utility lies in its role as a key building block for the creation of various organic compounds. This compound serves as a valuable intermediate in the synthesis of pharmaceuticals, agrochemicals, and other specialty chemicals. Through strategic reactions and transformations, Benzonitrile, 4-acetyl- can be employed to introduce specific functional groups or structural motifs into target molecules, allowing for the precise construction of complex organic frameworks. Its ability to participate in a range of chemical reactions makes it a valuable tool for synthetic chemists seeking to design and produce novel compounds with unique properties.

Literature

• Preparation of a family of hexanuclear rhenium cluster complexes containing 5-(phenyl)tetrazol-2-yl ligands and alkylation of 5-substituted tetrazolate ligands.

  Inorganic chemistry 20120716

• Synthesis of some thiophene, imidazole and pyridine derivatives exhibiting good anti-inflammatory and analgesic activities.

  Medicinal chemistry (Shariqah (United Arab Emirates)) 20080301

• Electronic effects of para-substitution on acetophenones in the reaction of rat liver 3alpha-hydroxysteroid dehydrogenase.

  Bioorganic & medicinal chemistry 20080201