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4-(1H-PYRAZOL-1-YL)BENZOYL CHLORIDE is a chemical compound characterized by the molecular formula C12H8ClN3O. It is a chlorinated derivative of benzoic acid, featuring a pyrazole ring that contributes to its reactivity and utility in various chemical processes. 4-(1H-PYRAZOL-1-YL)BENZOYL CHLORIDE is recognized for its role in organic synthesis, particularly in the creation of pharmaceuticals and agrochemicals, where its unique structure facilitates the formation of desired products.

220461-83-6

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220461-83-6 Usage

Uses

Used in Pharmaceutical Industry:
4-(1H-PYRAZOL-1-YL)BENZOYL CHLORIDE is utilized as a key reagent in the synthesis of various pharmaceuticals. Its presence in the reaction mixture allows for the formation of new compounds with potential therapeutic applications, making it an essential component in drug discovery and development processes.
Used in Agrochemical Industry:
In the agrochemical sector, 4-(1H-PYRAZOL-1-YL)BENZOYL CHLORIDE is employed as a reagent for the production of agrochemicals. Its ability to participate in organic synthesis reactions is leveraged to create compounds that can be used in the development of pesticides, herbicides, and other agricultural products to enhance crop protection and yield.
Used in Organic Synthesis Research:
4-(1H-PYRAZOL-1-YL)BENZOYL CHLORIDE is also used as a research tool in organic synthesis. Its reactivity and structural features make it a valuable compound for exploring new synthetic pathways and understanding the mechanisms of various chemical reactions.
Safety and Environmental Considerations:
Due to its potential to cause skin and eye irritation, as well as respiratory system irritation upon inhalation, 4-(1H-PYRAZOL-1-YL)BENZOYL CHLORIDE must be handled with care. Additionally, it is classified as toxic to aquatic life, which underscores the importance of proper management and disposal to minimize environmental impact.

Check Digit Verification of cas no

The CAS Registry Mumber 220461-83-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,2,0,4,6 and 1 respectively; the second part has 2 digits, 8 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 220461-83:
(8*2)+(7*2)+(6*0)+(5*4)+(4*6)+(3*1)+(2*8)+(1*3)=96
96 % 10 = 6
So 220461-83-6 is a valid CAS Registry Number.
InChI:InChI=1/C10H7ClN2O/c11-10(14)8-2-4-9(5-3-8)13-7-1-6-12-13/h1-7H

220461-83-6SDS

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 4-pyrazol-1-ylbenzoyl chloride

1.2 Other means of identification

Product number -
Other names 4-pyrazolylbenzoyl chloride

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:220461-83-6 SDS

220461-83-6Relevant academic research and scientific papers

Ammonia as Ultimate Amino Source in Synthesis of Primary Amines via Nickel-Promoted C-H Bond Amination

Yu, Lin,Yang, Chan,Yu, Yongqi,Liu, Da,Hu, Liang,Xiao, Yuanjiu,Song, Ze-Nan,Tan, Ze

supporting information, p. 5634 - 5638 (2019/08/01)

The direct use of ammonia in transition-metal promoted C-H bond amination for the synthesis of primary amines is considered to be one of the major challenges in synthetic organic chemistry. Herein, we report that such transformation can be successfully ac

Palladium-Catalyzed Decarbonylative Difluoromethylation of Acid Chlorides at Room Temperature

Pan, Fei,Boursalian, Gregory B.,Ritter, Tobias

supporting information, p. 16871 - 16876 (2018/11/23)

Methods for the direct synthesis of difluoromethylated arenes are sparse, despite the importance of the difluoromethyl group in medical, agro-, and materials chemistry. A palladium-catalyzed decarbonylative cross-coupling reaction of acid chlorides with a difluoromethyl zinc reagent is achieved to access difluoromethylated compounds. The transformation proceeds at room temperature and shows broad functional group tolerance, thus providing a general and efficient method for decarbonylative difluoromethylation of a wide range of aromatic carboxylic acids.

KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE

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Paragraph 0320; 0334; 0335, (2016/09/26)

Disclosed herein are new compounds and compositions and their application as pharmaceuticals for the treatment of diseases. Methods of inhibition of KDM1A, methods of increasing gamma globin gene expression, and methods to induce differentiation of cancer cells in a human or animal subject are also provided for the treatment of diseases such as acute myelogenous leukemia.

Amides that inhibit vanilloid receptor subtype 1 (VR1) receptor

-

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

The present invention relates to compounds of formula (I) that are novel VR1 antagonists useful in treating pain, inflammatory thermal hyperalgesia, urinary incontinence, or bladder overactivity.

Vasopressin agonist formulation and process

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Page/Page column 52, (2010/02/09)

This invention provides novel formulations for vasopressin agonist compounds, or a pharmaceutically acceptable salt thereof, having the general structure: and processes for making them, the formulations comprising from about 1% to about 20% of active ingredient, from about 1% to about 18% of a surfactant component, from about 50% to about 80% of a component of one or more polyethylene glycols, from about 1% to about 20% of a component of one or more sucrose fatty acid esters and/or polyvinylpyrrolidone and, optionally, one or more preservatives or antioxidants.

Tricyclic vasopressin agonists

-

, (2008/06/13)

This invention relates to new compounds selected from those of the general formula (I), or a pharmaceutically acceptable salt, ester or prodrug form thereof: wherein D, E and G are N or CH, which serve as vasopressin agonists and are useful in treating disorders such as diabetes insipidus, nocturnal enuresis, nocturia, urinary incontinence, bleeding and coagulation disorders, and the inability to temporarily delay urination and pharmaceutical compositions and methods for same.

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