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Ethyl 1-tert-butyl-5-chloro-1H-pyrazole-4-carboxylate is a chemical compound characterized by its molecular formula C11H16ClN3O2. It features a pyrazole ring with a carboxylic ester group, along with tert-butyl and ethyl substituents, and a chlorine atom. This unique structure endows it with potential medicinal properties and has been the subject of research for its antimicrobial, anti-inflammatory, and antifungal effects, making it a promising candidate for further development in medicinal chemistry.

112779-13-2

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112779-13-2 Usage

Uses

Used in Pharmaceutical Industry:
Ethyl 1-tert-butyl-5-chloro-1H-pyrazole-4-carboxylate is used as a building block in organic synthesis for the production of various drugs and pharmaceutical ingredients. Its unique structure and biological activities contribute to the development of new therapeutic agents.
Used in Medicinal Chemistry Research:
Ethyl 1-tert-butyl-5-chloro-1H-pyrazole-4-carboxylate is used as a subject of research for its potential medicinal properties, including its antimicrobial, anti-inflammatory, and antifungal effects. Its unique structure makes it an interesting target for further exploration and development in the field of medicinal chemistry.
Used in Antimicrobial Applications:
Ethyl 1-tert-butyl-5-chloro-1H-pyrazole-4-carboxylate is used as an antimicrobial agent, leveraging its biological activities to combat various microorganisms and contributing to the development of new antimicrobial drugs.
Used in Anti-inflammatory Applications:
Ethyl 1-tert-butyl-5-chloro-1H-pyrazole-4-carboxylate is used as an anti-inflammatory agent, potentially reducing inflammation and contributing to the development of new treatments for inflammatory conditions.
Used in Antifungal Applications:
Ethyl 1-tert-butyl-5-chloro-1H-pyrazole-4-carboxylate is used as an antifungal agent, targeting fungal infections and contributing to the development of new antifungal medications.

Check Digit Verification of cas no

The CAS Registry Mumber 112779-13-2 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,2,7,7 and 9 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 112779-13:
(8*1)+(7*1)+(6*2)+(5*7)+(4*7)+(3*9)+(2*1)+(1*3)=122
122 % 10 = 2
So 112779-13-2 is a valid CAS Registry Number.

112779-13-2SDS

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 1-tert-butyl-5-chloropyrazole-4-carboxylate

1.2 Other means of identification

Product number -
Other names Ethyl 1-(tert-butyl)-5-chloro-1H-pyrazole-4-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:112779-13-2 SDS

112779-13-2Downstream Products

112779-13-2Relevant academic research and scientific papers

Adamantyl-pyrazole carboxamides as inhibitors of 11B-hydroxysteroid dehydrogenase

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Page/Page column 19, (2008/06/13)

Provided herein are compounds of the formula (I): as well as pharmaceutically acceptable salts thereof, wherein the substituents are as those disclosed in the specification. These compounds, and the pharmaceutical compositions containing them, are useful for the treatment of diseases such as, for example, type II diabetes mellitus and metabolic syndrome.

Synthesis of 1-(1,1-Dimethylethyl)-1H-pyrazole-4-carboxylate Ester Derivatives

Beck, James R.,Lynch, Michael P.

, p. 693 - 695 (2007/10/02)

Attempts to prepare ethyl 5-cyano-1-(1,1-dimethylethyl)-1H-pyrazole-4-carboxylate (7) by the reaction of the corresponding 5-chloro derivative 1b with cyanide ion were unsuccessful.The chloro ester was synthesized from the corresponding amino ester 1a utilizing nonaqueous diazotization with nitrosyl chloride.An alternate process was developed which allowed the preparation of 7 from the corresponding 5-methyl ester 3 in four steps.The structure of N-methylamide 8 synthesized from 7 was confirmed by X-ray diffraction analysis.

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