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Ethyl 3-bromoisoxazole-5-carboxylate is a synthetic, organic chemical compound characterized by an isoxazole ring—a five-membered heterocyclic ring containing three carbon atoms, one oxygen atom, and one nitrogen atom. It also features a carboxylate group and a bromine atom, contributing to its molecular weight of 246.02 g/mol. This intriguing molecular structure makes it a valuable compound in research and development, particularly in the field of medicinal chemistry, where it serves as a potential building block for the synthesis of pharmaceutical drugs. Careful handling and adherence to safety protocols are essential when working with this chemical.

105174-97-8

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105174-97-8 Usage

Uses

Used in Medicinal Chemistry:
Ethyl 3-bromoisoxazole-5-carboxylate is used as a building block for the synthesis of pharmaceutical drugs due to its unique molecular structure. Its presence in the molecular framework can contribute to the development of new drug candidates with potential therapeutic applications.
Used in Research and Development:
In the field of organic chemistry, Ethyl 3-bromoisoxazole-5-carboxylate is used as a research compound to explore its reactivity and potential applications in the synthesis of complex molecules. Its properties and behavior in various chemical reactions can provide insights into the design of new chemical entities and materials.
Used in Drug Discovery:
Ethyl 3-bromoisoxazole-5-carboxylate is employed as a starting material in drug discovery processes, where its structural features can be exploited to create novel compounds with potential medicinal properties. Its versatility in chemical modifications makes it a valuable asset in the search for new therapeutic agents.
Used in Chemical Synthesis:
Ethyl 3-bromoisoxazole-5-carboxylate is used as a synthetic intermediate in the preparation of various organic compounds. Its presence in the synthesis process can lead to the formation of complex molecules with diverse applications in different industries, including pharmaceuticals, materials science, and agrochemicals.

Check Digit Verification of cas no

The CAS Registry Mumber 105174-97-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,0,5,1,7 and 4 respectively; the second part has 2 digits, 9 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 105174-97:
(8*1)+(7*0)+(6*5)+(5*1)+(4*7)+(3*4)+(2*9)+(1*7)=108
108 % 10 = 8
So 105174-97-8 is a valid CAS Registry Number.
InChI:InChI=1/C6H6BrNO3/c1-2-10-6(9)4-3-5(7)8-11-4/h3H,2H2,1H3

105174-97-8SDS

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 3-bromoisoxazole-5-carboxylate

1.2 Other means of identification

Product number -
Other names ethyl 3-bromo-1,2-oxazole-5-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:105174-97-8 SDS

105174-97-8Relevant academic research and scientific papers

Process for the preparation of 3,5-disubstituted isoxazoles

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, (2008/06/13)

A novel process for the preparation of 3-bromo- and 3-chloro-5-substituted isoxazoles is provided. Dibromo- or dichloro-formaldoxime is reacted with an excess of an 1-alkyne derivative of the formula where R is hydrogen, phenyl or 1-6 C alkyl optionally substituted by halogen, OH, OR', CHO, COR', COOR', CONH2, CONR'R" or NHCOR' where, in turn, R' and R", which may be the same or different, are a 1-6 C alkyl or haloalkyl, in the presence of (i) at least an equimolecular amount, with respect to the dibromo- or dichloro-formaldoxime, of an alkaline base selected from the class consisting of sodium and potassium carbonate and bicarbonate and (ii) an inert solvent in which the 1-alkyne is soluble at room temperature.

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