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1H-Imidazole-4-carboxaldehyde, 5-nitro(9CI) is a chemical compound characterized by its molecular formula C5H4N4O2. It is a yellow crystalline solid that serves as a crucial intermediate in the synthesis of a variety of pharmaceuticals, agricultural chemicals, and dyes. The presence of a nitro group in its structure makes it a significant building block for numerous organic reactions, and it is also utilized as a starting material for the synthesis of complex heterocyclic compounds. With potential applications in medicinal chemistry, 1H-Imidazole-4-carboxaldehyde, 5-nitro- (9CI) has garnered interest for its antimicrobial and antifungal properties, positioning it as a valuable asset in the development of novel drugs.

81246-34-6

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81246-34-6 Usage

Uses

Used in Pharmaceutical Industry:
1H-Imidazole-4-carboxaldehyde, 5-nitro(9CI) is used as a key intermediate in the synthesis of various pharmaceuticals due to its ability to participate in numerous organic reactions, facilitating the creation of a wide range of medicinal compounds.
Used in Agricultural Chemicals:
In the agricultural sector, 1H-Imidazole-4-carboxaldehyde, 5-nitro(9CI) is employed as a starting material for the development of agricultural chemicals, contributing to the production of effective and innovative products for crop protection and enhancement.
Used in Dye Industry:
1H-Imidazole-4-carboxaldehyde, 5-nitro(9CI) is utilized as an intermediate in the dye industry, playing a role in the production of various dyes that have applications in different areas, including textiles and other industrial processes.
Used in Medicinal Chemistry Research:
1H-Imidazole-4-carboxaldehyde, 5-nitro(9CI) is used as a starting material for the synthesis of complex heterocyclic compounds, which are of interest in medicinal chemistry for their potential therapeutic properties and applications.
Used in Antimicrobial and Antifungal Drug Development:
Given its antimicrobial and antifungal properties, 1H-Imidazole-4-carboxaldehyde, 5-nitro(9CI) is a valuable compound in the research and development of new drugs aimed at combating infections caused by resistant microorganisms.

Check Digit Verification of cas no

The CAS Registry Mumber 81246-34-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,1,2,4 and 6 respectively; the second part has 2 digits, 3 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 81246-34:
(7*8)+(6*1)+(5*2)+(4*4)+(3*6)+(2*3)+(1*4)=116
116 % 10 = 6
So 81246-34-6 is a valid CAS Registry Number.

81246-34-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-nitro-1H-imidazole-5-carbaldehyde

1.2 Other means of identification

Product number -
Other names 4-formyl-5-nitroimidazole

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:81246-34-6 SDS

81246-34-6Downstream Products

81246-34-6Relevant articles and documents

Mass Spectrometry of Imidazole-4(5)-carboxaldehyde and Some 1-Methyl and Nitro Derivatives

Cert, Arturo,Delgado-Cobos, Pedro,Perez-Lanzac, Mariana Trujillo

, p. 499 - 506 (2007/10/02)

The mass spectra of imidazole-4(5)-carboxaldehyde, its two 1-methyl derivatives, 4(5)-nitroimidazole, 5(4)-nitroimidazole-4(5)-carboxaldehyde and 1-methyl-5-nitroimidazole-4-carboxaldehyde are presented and discussed in comparison with those of other imidazole-carboxaldehydes and nitroimidazoles earlier reported.The imidazole-carboxaldehydes and their 1-methyl derivatives exhibit the characteristic fragmentation of aromatic aldehydes, and differences between the isomers can be observed.The nitroimidazoles show the fragmentation typical of aromatic nitrocompounds.In the o-nitroimidazole-carboxaldehydes, the typical losses of aldehydes do not occur, but primary ortho effects between the formyl and nitro groups give rise to important fragmentation routes.In their 1-methyl derivatives, the presence of the methyl group adjacent to the nitro group originates additional double and secondary ortho effects.For some of these transformations, fragmentation mechanisms are proposed.

4,5-DISUBSTITUTED IMIDAZOLES. PART I. 4-HYDROXYMETHYL-5-NITROIMIDAZOLE, 4-FORMYL-5-NITROIMIDAZOLE AND THEIR N-SUBSTITUTED DERIVATIVES

Bochwic, Boleslaw,Frankowski, Andrzej,Kuswik, Gabriela,Seliga, Czeslawa

, p. 1055 - 1061 (2007/10/02)

A synthesis of 4-hydroxymethyl-5-nitroimidazole, 4-formyl-5-nitroimidazole, their N-methyl and N-trityl derivatives were developed starting from easily accessible 4-hydroxymethylimidazole.The structures of N-substituted derivatives have been assumed on the basis of analyzing the 1H NMR data.

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