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4-Nitro-1-methylbenzimidazole, a chemical compound with the molecular formula C8H6N4O2, is a derivative of benzimidazole featuring a nitro group and a methyl group attached to the benzene ring. This yellowish-brown solid, with a melting point of approximately 216-218°C, is recognized for its role as an intermediate in the synthesis of pharmaceuticals, agrochemicals, and organic dyes. It also serves as a reagent in organic synthesis and a building block for other organic compounds. Due to its potential toxicity and environmental impact, 4-Nitro-1-methylbenzimidazole is classified as a hazardous material that requires careful handling.

31493-66-0

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31493-66-0 Usage

Uses

Used in Pharmaceutical Industry:
4-Nitro-1-methylbenzimidazole is used as a chemical intermediate for the synthesis of various pharmaceuticals. Its unique structure allows it to be a key component in the development of new drugs, contributing to the advancement of medicinal chemistry.
Used in Agrochemical Industry:
In the agrochemical sector, 4-Nitro-1-methylbenzimidazole serves as an intermediate in the production of agrochemicals. Its properties make it suitable for the creation of compounds that can be used in pest control and crop protection, thereby supporting agricultural productivity.
Used in Dye Industry:
4-Nitro-1-methylbenzimidazole is utilized as an intermediate in the synthesis of organic dyes. Its chemical structure provides a foundation for the development of dyes with specific color characteristics, which are essential in various industries such as textiles, printing, and plastics.
Used in Organic Synthesis:
As a reagent in organic synthesis, 4-Nitro-1-methylbenzimidazole is employed to facilitate various chemical reactions. Its presence can enhance the efficiency and selectivity of these reactions, making it a valuable tool in the synthesis of complex organic compounds.
Used in the Preparation of Other Organic Compounds:
4-Nitro-1-methylbenzimidazole also functions as a building block for the preparation of other organic compounds. Its versatile structure allows it to be incorporated into a wide range of molecules, expanding the scope of organic chemistry and contributing to the discovery of new materials and substances.

Check Digit Verification of cas no

The CAS Registry Mumber 31493-66-0 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,1,4,9 and 3 respectively; the second part has 2 digits, 6 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 31493-66:
(7*3)+(6*1)+(5*4)+(4*9)+(3*3)+(2*6)+(1*6)=110
110 % 10 = 0
So 31493-66-0 is a valid CAS Registry Number.
InChI:InChI=1/C8H7N3O2/c1-10-5-9-8-6(10)3-2-4-7(8)11(12)13/h2-5H,1H3

31493-66-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-methyl-4-nitrobenzimidazole

1.2 Other means of identification

Product number -
Other names 4-nitro-1-methylbenzimidazole

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:31493-66-0 SDS

31493-66-0Downstream Products

31493-66-0Relevant academic research and scientific papers

Benzimidazole-based anion receptors: Tautomeric switching and selectivity

Gale, Philip A.,Hiscock, Jennifer R.,Lalaoui, Noémie,Light, Mark E.,Wells, Neil J.,Wenzel, Marco

supporting information; experimental part, p. 5909 - 5915 (2012/08/28)

Tautomeric switching is observed in a series of benzimidazole-based anion receptors upon addition of basic anions. An N-methylbenzimidazole based receptor selectively interacts with dihydrogen phosphate over a variety of other putative anionic guests via a combination of donated and accepted hydrogen bonds.

Silver(I)-mediated cytosine self-pairing is preferred over hoogsteen-type base pairs with the artificial nucleobase 1,3-dideaza-6-nitropurine

Megger, Dominik A.,Mueller, Jens

scheme or table, p. 27 - 38 (2010/07/06)

A 2′-deoxyribonucleoside containing 1,3-dideaza-6-nitropurine was synthesized and incorporated into oligonucleotides. The acid-base properties of this nucleoside and the corresponding N9-methylated derivative were investigated by pD-dependent 1H NMR spectroscopy. A possible formation of Hoogsteen-type base pairs with cytosine was studied by ultraviolet (UV) and circular dichroism (CD) spectroscopy in the presence and absence of Ag(I) and under neutral and acidic conditions, respectively. In each case, no indication for the formation of Hoogsteen-type base pairs was obtained, which is attributed to the higher affinity of cytosine to form self-complementary hemi-protonated base pairs under acidic conditions and metal-mediated homo base pairs in presence of Ag(I), respectively.

New route for preparation of nitrosubstituted 1,2-phenylenediamines

Bella, Maros,Milata, Viktor

, p. 425 - 427 (2008/09/19)

(Chemical Equation Presented) 4-Nitrobenzoselenadiazole was methylated with dimethylsulphate to give corresponding 1-N-methyl-4-nitrobenzoselenadiazolium methylsulphate which after alkaline ring-opening afforded 1-N-methyl-3-nitro-1, 2-phenylenediamine in

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