CAS 104-04-1 | N-(4-Nitrophenyl)acetamide | CAS Number 104-04-1

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104-04-1 | N-(4-Nitrophenyl)acetamide

CAS No: 104-04-1 Catalog No: AG003LUY MDL No:MFCD00007303

Product Description

Catalog Number:

AG003LUY

Chemical Name:

N-(4-Nitrophenyl)acetamide

CAS Number:

104-04-1

Molecular Formula:

C8H8N2O3

Molecular Weight:

180.1607

MDL Number:

MFCD00007303

IUPAC Name:

N-(4-nitrophenyl)acetamide

InChI:

InChI=1S/C8H8N2O3/c1-6(11)9-7-2-4-8(5-3-7)10(12)13/h2-5H,1H3,(H,9,11)

InChI Key:

NQRLPDFELNCFHW-UHFFFAOYSA-N

SMILES:

CC(=O)Nc1ccc(cc1)[N+](=O)[O-]

EC Number:

203-169-0

UNII:

PH3B066365

NSC Number:

1315

Properties

Complexity:

204

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

180.053g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

180.163g/mol

Monoisotopic Mass:

180.053g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

74.9A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.7

Literature

Title	Journal
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