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1-(3-amino-5-nitro-phenyl)ethanone, also known as 3-amino-5-nitroacetophenone, is a yellow crystalline solid with a molecular formula of C8H8N2O3. It is a chemical compound commonly used in organic synthesis and as an intermediate in the production of various pharmaceuticals and other organic compounds. 1-(3-amino-5-nitro-phenyl)ethanone is also known for its potential applications in the field of medicinal chemistry, where it can be used as a building block for the synthesis of novel drugs and pharmaceuticals. Additionally, 1-(3-amino-5-nitro-phenyl)ethanone has been studied for its various biological activities, including its potential as an antimicrobial and antifungal agent.

5456-49-5

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5456-49-5 Usage

Uses

Used in Organic Synthesis:
1-(3-amino-5-nitro-phenyl)ethanone is used as a key intermediate in the synthesis of various organic compounds, contributing to the formation of complex molecules and facilitating chemical reactions.
Used in Pharmaceutical Production:
As an intermediate, 1-(3-amino-5-nitro-phenyl)ethanone is used in the production of various pharmaceuticals, playing a crucial role in the development of new drugs and medicines.
Used in Medicinal Chemistry:
1-(3-amino-5-nitro-phenyl)ethanone is utilized as a building block in medicinal chemistry for the synthesis of novel drugs and pharmaceuticals, potentially leading to the discovery of new therapeutic agents.
Used in Antimicrobial Applications:
1-(3-amino-5-nitro-phenyl)ethanone is studied for its potential as an antimicrobial agent, which could be used in the development of treatments for bacterial infections.
Used in Antifungal Applications:
1-(3-amino-5-nitro-phenyl)ethanone is also being investigated for its antifungal properties, indicating its potential use in combating fungal infections and related diseases.

Check Digit Verification of cas no

The CAS Registry Mumber 5456-49-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,4,5 and 6 respectively; the second part has 2 digits, 4 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 5456-49:
(6*5)+(5*4)+(4*5)+(3*6)+(2*4)+(1*9)=105
105 % 10 = 5
So 5456-49-5 is a valid CAS Registry Number.
InChI:InChI=1/C8H8N2O3/c1-5(11)6-2-7(9)4-8(3-6)10(12)13/h2-4H,9H2,1H3

5456-49-5SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-(3-amino-5-nitrophenyl)ethanone

1.2 Other means of identification

Product number -
Other names Aniline,3-acetyl-5-nitro

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:5456-49-5 SDS

5456-49-5Relevant academic research and scientific papers

Fragment-based drug discovery of 2-thiazolidinones as BRD4 inhibitors: 2. Structure-based optimization

Zhao, Lele,Wang, Yingqing,Cao, Danyan,Chen, Tiantian,Wang, Qi,Li, Yanlian,Xu, Yechun,Zhang, Naixia,Wang, Xin,Chen, Danqi,Chen, Lin,Chen, Yue-Lei,Xia, Guangxin,Shi, Zhe,Liu, Yu-Chih,Lin, Yijyun,Miao, Zehong,Shen, Jingkang,Xiong, Bing

, p. 1281 - 1297 (2015/03/04)

The signal transduction of acetylated histone can be processed through a recognition module, bromodomain. Several inhibitors targeting BRD4, one of the bromodomain members, are in clinical trials as anticancer drugs. Hereby, we report our efforts on discovery and optimization of a new series of 2-thiazolidinones as BRD4 inhibitors along our previous study. In this work, guided by crystal structure analysis, we reversed the sulfonamide group and identified a new binding mode. A structure-activity relationship study on this new series led to several potent BRD4 inhibitors with IC50 of about 0.05-0.1 μM in FP binding assay and GI50 of 0.1-0.3 μM in cell based assays. To complete the lead-like assessment of this series, we further checked its effects on BRD4 downstream protein c-Myc, investigated its selectivity among five different bromodomain proteins, as well as the metabolic stability test, and reinforced the utility of 2-thiazolidinone scaffold as BET bromodomain inhibitors in novel anticancer drug development.

Zinc Mediated Friedel-Crafts Acylation in Solvent-Free Conditions under Microwave Irradiation

Paul, Satya,Nanda, Puja,Gupta, Rajive,Loupy, Andre

, p. 2877 - 2881 (2007/10/03)

Zn powder is found to catalyze the Friedel-Crafts acylation of aromatic compounds with acyl halides efficiently under microwave irradiation in solvent-free conditions. Activated substrates undergo acylation predominantly at the para-position. The Zn powder can be re-used up to six times after simple washing with diethyl ether and dilute HCl.

Tricyclic compounds and drug compositions containing the same

-

, (2008/06/13)

Compounds having a β-3 adrenaline receptor agonist and are useful as drugs for the treatment and prevention of diabetes, obesity, hyperlipemia, etc., represented by a general formula (I) and salts thereof, and a process for producing these, and their intermediates, wherein R represents hydrogen or methyl; R1 represents hydrogen, halogen, hydroxy, benzyloxy, amino, or hydroxymethyl; R2 represents hydrogen, hydroxymethyl, NHR3, SO2 NR4 R4', or nitro; R6 represents hydrogen or lower alkyl; and X represents nitrogen, R9 represents hydrogen, one of R7 and R8 represent hydrogen, and the other thereof represents hydrogen, amino, acetylamino, or hydroxy.

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