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Ethanone, 2-chloro-1-(1-methyl-1H-pyrrol-3-yl)(9CI), also known as 2-Chloro-1-(1-methyl-1H-pyrrol-3-yl)ethanone, is a chlorinated derivative of a pyrrole-containing ketone with the molecular formula C8H8ClNO. This chemical compound is characterized by its unique structure and properties, making it a valuable tool in pharmaceutical research, organic synthesis, drug development, and medicinal chemistry. It is also commonly used as a reference standard in analytical chemistry and chemical research.

126624-55-3

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126624-55-3 Usage

Uses

Used in Pharmaceutical Research:
Ethanone, 2-chloro-1-(1-methyl-1H-pyrrol-3-yl)(9CI) is used as a building block in pharmaceutical research for the development of new drugs. Its unique structure and properties allow it to be incorporated into various drug candidates, potentially leading to the discovery of novel therapeutic agents.
Used in Organic Synthesis:
In the field of organic synthesis, Ethanone, 2-chloro-1-(1-methyl-1H-pyrrol-3-yl)(9CI) serves as a versatile intermediate for the synthesis of a wide range of organic compounds. Its reactivity and functional groups make it suitable for various synthetic transformations, enabling the preparation of complex molecules and advanced materials.
Used in Drug Development:
Ethanone, 2-chloro-1-(1-methyl-1H-pyrrol-3-yl)(9CI)'s structure and properties make it a valuable tool for drug development, as it can be used to design and optimize drug candidates with improved pharmacological properties. Its potential applications in drug development include the synthesis of new bioactive molecules, the modification of existing drugs to enhance their efficacy and safety, and the development of prodrugs that can be converted into active therapeutic agents in the body.
Used in Medicinal Chemistry:
Ethanone, 2-chloro-1-(1-methyl-1H-pyrrol-3-yl)(9CI) is utilized in medicinal chemistry for the study of structure-activity relationships and the optimization of drug candidates. Its unique features allow researchers to investigate the effects of structural modifications on the biological activity and pharmacokinetic properties of compounds, ultimately leading to the design of more effective and safer drugs.
Used as a Reference Standard in Analytical Chemistry and Chemical Research:
Due to its well-defined structure and properties, Ethanone, 2-chloro-1-(1-methyl-1H-pyrrol-3-yl)(9CI) is often used as a reference standard in analytical chemistry and chemical research. It serves as a benchmark for the evaluation of analytical methods, the calibration of instruments, and the comparison of experimental results, ensuring the accuracy and reliability of scientific findings.

Check Digit Verification of cas no

The CAS Registry Mumber 126624-55-3 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,2,6,6,2 and 4 respectively; the second part has 2 digits, 5 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 126624-55:
(8*1)+(7*2)+(6*6)+(5*6)+(4*2)+(3*4)+(2*5)+(1*5)=123
123 % 10 = 3
So 126624-55-3 is a valid CAS Registry Number.
InChI:InChI=1/C7H8ClNO/c1-9-3-2-6(5-9)7(10)4-8/h2-3,5H,4H2,1H3

126624-55-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-chloro-1-(1-methylpyrrol-3-yl)ethanone

1.2 Other means of identification

Product number -
Other names 1-Methyl-3-chloroacetylpyrrole

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:126624-55-3 SDS

126624-55-3Downstream Products

126624-55-3Relevant academic research and scientific papers

Selective α-Chlorination of Acetylpyrroles

Croce, Piero Dalla,Ferraccioli, Rafaella,Ritieni, Alberto

, p. 212 - 213 (2007/10/02)

Reaction of acetylpyrroles with benzyltrimethylammonium dichloroiodate in tetrahydrofuran solution leads to the corresponding α-chloro derivatives with high selectivity and good yields.

Direct Vilsmeier-Haack Chloroacetylation of Pyrroles

Croce, Piero Dalla,Rosa, Concetta La,Ritieni, Alberto

, p. 783 - 784 (2007/10/02)

Reaction of pyrroles with N,N-dimethyl-2-chloroacetamide in the presence of phosphorus oxychloride leads to a mixture of 2- and 3-chloroacetylpyrroles, which can be separated by chromatography.

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