104-04-1 | 4'-Nitroacetanilide

Packsize	Purity	Availability	Price	Discounted Price
250mg	98%	in stock	$15.00	$10.00
5g	98%	in stock	$15.00	$11.00
25g	98%	in stock	$49.00	$34.00
100g	98%	in stock	$141.00	$99.00

Description

• Catalog Number: AB68098
• Chemical Name: 4'-Nitroacetanilide
• CAS Number: 104-04-1
• Molecular Formula: C8H8N2O3
• Molecular Weight: 180.1607
• MDL Number: MFCD00007303
• SMILES: CC(=O)Nc1ccc(cc1)[N+](=O)[O-]
• NSC Number: 1315

Computed Properties

• Complexity: 204
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.7

Upstream Synthesis Route

4-Nitroacetanilide is a versatile chemical compound commonly utilized in chemical synthesis due to its reactivity and unique properties. In organic chemistry, it serves as a key intermediate in the production of various pharmaceuticals, dyes, and agrochemicals. The presence of the nitro group on the acetanilide molecule makes 4-Nitroacetanilide a valuable precursor for synthesizing other important compounds through various chemical reactions, such as reduction, substitution, and coupling processes. Additionally, its ability to undergo nitration and subsequent functional group transformations allows for the creation of tailored molecules with specific properties for a wide range of applications. This compound plays a crucial role in the development of novel materials and substances, highlighting its significance in the field of chemical synthesis.

Literature

• Cloning and characterization of a novel amidase from Paracoccus sp. M-1, showing aryl acylamidase and acyl transferase activities.

  Applied microbiology and biotechnology 20120501

• Improved accuracy in high-temperature conversion elemental analyzer δ18O measurements of nitrogen-rich organics.

  Rapid communications in mass spectrometry : RCM 20120315

• Molecular characterization of a novel bacterial aryl acylamidase belonging to the amidase signature enzyme family.

  Molecules and cells 20100501

• A novel aryl acylamidase from Nocardia farcinica hydrolyses polyamide.

  Biotechnology and bioengineering 20090301

• Gene cloning and characterization of arylamine N-acetyltransferase from Bacillus cereus strain 10-L-2.

  Journal of bioscience and bioengineering 20090101

• Human butyrylcholinesterase components differ in aryl acylamidase activity.

  Biological chemistry 20080401

• Kinetic properties of wild-type and altered recombinant amidases by the use of ion-selective electrode assay method.

  Analytical biochemistry 20060815

• N-(4-Trifluoromethylphenyl)amide group of the synthetic histamine receptor agonist inhibits nicotinic acetylcholine receptor-mediated catecholamine secretion.

  Biochemical pharmacology 20060227

• Role of protein conformational mobility in enzyme catalysis: acylation of alpha-chymotrypsin by specific peptide substrates.

  Biochemistry 20040127

• Enzymatic hydrolysis of p-nitroacetanilide: mechanistic studies of the aryl acylamidase from Pseudomonas fluorescens.

  Biochemistry 20020122

• Substitutions of Thr-103-Ile and Trp-138-Gly in amidase from Pseudomonas aeruginosa are responsible for altered kinetic properties and enzyme instability.

  Molecular biotechnology 20010301

• Design and synthesis of benzoic acid derivatives as influenza neuraminidase inhibitors using structure-based drug design.

  Journal of medicinal chemistry 19971205