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Ethyl 5-nitro-2,6-dioxo-3H-pyrimidine-4-carboxylate is an organic chemical compound belonging to the Pyrimidines and Pyrimidine derivatives family. It is characterized by the presence of a 2,6-dioxo-3H-pyrimidine moiety, a nitro group (-NO2), and an ethyl group attached to a carboxylate. With a molecular formula of C7H6N2O6 and an exact mass of 218.0215 g/mol, ethyl 5-nitro-2,6-dioxo-3H-pyrimidine-4-carboxylate is widely used in academic and industrial research as a reagent or intermediate in chemical synthesis processes. For safety concerns, its handling, toxicological, and environmental impact information can be found in the material safety data sheet provided by the supplier.

52047-16-2

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52047-16-2 Usage

Uses

Used in Academic and Industrial Research:
Ethyl 5-nitro-2,6-dioxo-3H-pyrimidine-4-carboxylate is used as a reagent or intermediate in chemical synthesis processes for its unique structural features and properties. It contributes to the development of new compounds and materials in various fields of research.
Used in Chemical Synthesis:
In the chemical synthesis industry, ethyl 5-nitro-2,6-dioxo-3H-pyrimidine-4-carboxylate serves as a key intermediate, facilitating the production of various pharmaceuticals, agrochemicals, and other specialty chemicals. Its versatile structure allows for further functionalization and modification, enabling the synthesis of a wide range of target molecules.
Used in Material Science:
Ethyl 5-nitro-2,6-dioxo-3H-pyrimidine-4-carboxylate can be employed in the development of advanced materials, such as polymers, coatings, and composites, due to its reactive functional groups and compatibility with various other chemical entities. Its incorporation into these materials can impart unique properties and improve performance in specific applications.
Used in Pharmaceutical Development:
As a component of the Pyrimidines and Pyrimidine derivatives family, ethyl 5-nitro-2,6-dioxo-3H-pyrimidine-4-carboxylate holds potential in the pharmaceutical industry. It can be utilized in the design and synthesis of new drug candidates, particularly those targeting various diseases and conditions. Its unique structure and functional groups may contribute to the development of novel therapeutic agents with improved efficacy and selectivity.

Check Digit Verification of cas no

The CAS Registry Mumber 52047-16-2 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,2,0,4 and 7 respectively; the second part has 2 digits, 1 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 52047-16:
(7*5)+(6*2)+(5*0)+(4*4)+(3*7)+(2*1)+(1*6)=92
92 % 10 = 2
So 52047-16-2 is a valid CAS Registry Number.
InChI:InChI=1/C7H7N3O6/c1-2-16-6(12)3-4(10(14)15)5(11)9-7(13)8-3/h2H2,1H3,(H2,8,9,11,13)

52047-16-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name Ethyl 5-nitro-2,6-dioxo-1,2,3,6-tetrahydropyrimidine-4-carboxylate

1.2 Other means of identification

Product number -
Other names ethyl 5-nitro-2,4-dioxo-1H-pyrimidine-6-carboxylate

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:52047-16-2 SDS

52047-16-2Relevant academic research and scientific papers

NITROGEN HETEROCYCLIC COMPOUNDS AND METHODS OF USE

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Paragraph 1808; 1809, (2021/06/26)

The present disclosure relates to compounds of formula (I): and pharmaceutically acceptable salts and stereoisomers thereof. The present disclosure also relates to methods of preparing the compounds, compositions comprising the compounds, and methods of using the compounds as inhibitors of receptor tyrosine kinases, in particular oncogenic mutants of ErbB-receptors e.g. in the treatment of cancer.

Method for synthesizing 2-chloro-5-amino-6-pyrimidine ethyl formate

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Paragraph 0019; 0022; 0025; 0028; 0031; 0034; 0037; 0040, (2019/11/28)

The invention discloses a method for synthesizing 2-chloro-5-amino-6-pyrimidine ethyl formate. The method comprises the following steps: firstly, enabling fuming nitric acid, concentrated sulfuric acid and orotic acid to react so as to obtain nitroorotic acid; further mixing the obtained nitroorotic acid with ethanol, and adding dropwise the concentrated sulfuric acid at room temperature so as toobtain nitroorotic acid ethyl ester; enabling the nitroorotic acid ethyl ester to react with phosphorus oxychloride and an organic alkali so as to obtain 2,4-dichloro-5-nitro-6-pyrimidine ethyl formate; and finally mixing the 2,4-dichloro-5-nitro-6-pyrimidine ethyl formate with palladium carbon and magnesium oxide, putting the mixture into tetrahydrofuran, and performing a reaction, so as to obtain a final product. By adopting the method, the orotic acid in the market is adopted as a raw material, and the 2-chloro-5-amino-6-pyrimidine ethyl formate is prepared through reactions of nitration, esterification, chlorination and reduction. The method is convenient in process operation, simple in operation, gentle in reaction and small in pollution, in addition, the prepared pyrimidine is high in yield and purity and small in environment pollution, and the prepared 2-chloro-5-amino-6-pyrimidine ethyl formate prepared by using the method can be applied to large-scale production.

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