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130648

4-Nitroacetanilide

Name: 4-Nitroacetanilide
Brand: ALDRICH

98%

Synonym(s):

4′-Nitroacetanilide, Acetic acid 4-nitroanilide

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About This Item

Linear Formula:

CH₃CONHC₆H₄NO₂

CAS Number:

104-04-1

Molecular Weight:

180.16

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24847974

EC Number:

203-169-0

Beilstein/REAXYS Number:

2211962

MDL number:

MFCD00007303

Assay:

98%

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Properties

Quality Level

100

assay

98%

mp

213-215 °C (lit.)

functional group

amide, nitro

SMILES string

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

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

Description

Application

4-Nitroacetanilide was used as a test substrate and its hydrolysis was determined by UV spectroscopic measurements. It was also used to prepare 4-aminoacetanilide.

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pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

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

Ross L Stein

Biochemistry, 41(3), 991-1000 (2002-01-16)

Aryl acylamidase (EC 3.1.5.13; AAA) catalyzes the hydrolysis of p-nitroacetanilide (PNAA) via the standard three-step mechanism of serine hydrolases: binding of substrate (K(s)), acylation of active-site serine (k(acyl)), and hydrolytic deacylation (k(deacyl)). Key mechanistic findings that emerged from this study

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

Shinji Takenaka et al.

Journal of bioscience and bioengineering, 107(1), 27-32 (2009-01-17)

Bacillus cereus strain 10-L-2 synthesizes two arylamine N-acetyltransferases (Nat-a and Nat-b) with broad substrate specificities toward aniline and its derivatives. In southern blot analysis using probes encoding the NH2-terminus of Nat-b and a conserved region of N-acetyltransferases, digested total DNA

Dinuclear Nickel(II) Complexes as Models for the Active Site of Urease.

Dirk Volkmer et al.

Inorganic chemistry, 35(13), 3792-3803 (1996-06-19)

Dinuclear nickel(II) complexes of the ligands 2,6-bis[bis((2-benzimidazolylmethyl)amino)methyl]-p-cresol (bbapOH), N,N,N',N'-tetrakis(2-benzimidazolylmethyl)-2-hydroxy-1,3-diaminopropane (tbpOH), N-methyl-N,N',N'-tris(2-benzimidazolylmethyl)-2-hydroxy-1,3-diaminopropane (m-tbpOH) and 1-[N,N-bis(2-benzimidazolylmethyl)amino]-3-[2-(3,5-dimethyl-1H-pyrazol-1-yl)ethoxy]-2-hydroxypropane (bpepOH) were prepared in order to model the active site of urease. The novel asymmetric structures of the dinuclear complexes were characterized by X-ray structure analysis.

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Global Trade Item Number

SKU	GTIN
48305-250G-F	04061833440438
48305-50G-F	04061832389851
130648-5G	04061838727596