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3-CYANO-5-METHYL-BENZOIC ACID is a chemical compound characterized by the molecular formula C9H7NO2. It is a member of the benzoic acid class, which includes organic compounds with a carboxylic acid group attached to a benzene ring. This specific compound features a cyano group (-CN) and a methyl group (-CH3) as substituents on the benzene ring. It is recognized for its applications in the pharmaceutical and agrochemical sectors, where it serves as a key building block in the synthesis of a variety of drugs and pesticides. Furthermore, it has been investigated for its potential biological activities, such as antimicrobial and anti-inflammatory properties. However, it is also noted for being a mild skin irritant, which can cause discomfort upon contact.

78621-81-5

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78621-81-5 Usage

Uses

Used in Pharmaceutical Industry:
3-CYANO-5-METHYL-BENZOIC ACID is used as a chemical intermediate for the synthesis of various pharmaceutical compounds. Its unique structure allows for the development of new drugs with potential therapeutic applications.
Used in Agrochemical Industry:
In the agrochemical sector, 3-CYANO-5-METHYL-BENZOIC ACID is utilized as a precursor in the production of pesticides. Its incorporation into these chemical formulations contributes to the effectiveness of pest control strategies in agriculture.
Used in Research and Development:
3-CYANO-5-METHYL-BENZOIC ACID is employed as a subject of study in biological research. Its antimicrobial and anti-inflammatory properties are of particular interest, as they may lead to the discovery of new treatments for various diseases and conditions.
Used in Chemical Synthesis:
As a building block in chemical synthesis, 3-CYANO-5-METHYL-BENZOIC ACID is used to create a range of derivative compounds. These derivatives can have diverse applications across different industries, including the development of new materials and the enhancement of existing products.

Check Digit Verification of cas no

The CAS Registry Mumber 78621-81-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,8,6,2 and 1 respectively; the second part has 2 digits, 8 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 78621-81:
(7*7)+(6*8)+(5*6)+(4*2)+(3*1)+(2*8)+(1*1)=155
155 % 10 = 5
So 78621-81-5 is a valid CAS Registry Number.
InChI:InChI=1/C9H7NO2/c1-6-2-7(5-10)4-8(3-6)9(11)12/h2-4H,1H3,(H,11,12)

78621-81-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-Cyano-5-methylbenzoic acid

1.2 Other means of identification

Product number -
Other names 5-CYANO-3-METHYLBENZOIC ACID

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:78621-81-5 SDS

78621-81-5Relevant academic research and scientific papers

Heteropolycyclic compounds and their use as metabotropic glutamate receptor antagonists

-

, (2008/06/13)

The present invention provides compounds and pharmaceutical compositions that act as antagonists at metabotropic glutamate receptors, and that are useful for treating neurological diseases and disorders. Methods of preparing the compounds also are disclosed.

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