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3-bromo-4-(2-methylpropoxy)benzonitrile is a chemical compound characterized by the molecular formula C11H12BrNO. It is a nitrile derivative, featuring a benzonitrile group with a bromine atom at the 3rd position and a 2-methylpropoxy group at the 4th position. 3-bromo-4-(2-methylpropoxy)benzonitrile is recognized for its colorless to pale yellow liquid form, accompanied by a faint aromatic scent. It is also known to be a skin and eye irritant, necessitating careful handling with appropriate protective measures to mitigate potential health risks.

208665-95-6

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208665-95-6 Usage

Uses

Used in Organic Synthesis:
3-bromo-4-(2-methylpropoxy)benzonitrile serves as a valuable building block in the realm of organic synthesis. Its unique structure makes it a key component in the preparation of a diverse array of pharmaceuticals, agrochemicals, and other fine chemicals. Its versatility in chemical reactions and compatibility with various synthetic pathways contribute to its widespread application in the development of new and improved chemical products.
Used in Pharmaceutical Industry:
Within the pharmaceutical sector, 3-bromo-4-(2-methylpropoxy)benzonitrile is utilized as a crucial intermediate in the synthesis of various medicinal compounds. Its presence in the molecular structure of these compounds can influence their pharmacological properties, such as potency, selectivity, and bioavailability. 3-bromo-4-(2-methylpropoxy)benzonitrile's reactivity and functional groups enable the creation of new drug candidates with potential therapeutic benefits.
Used in Agrochemical Industry:
In the agrochemical industry, 3-bromo-4-(2-methylpropoxy)benzonitrile is employed as a precursor in the synthesis of pesticides and other crop protection agents. Its incorporation into these chemical products can enhance their effectiveness in controlling pests and diseases, thereby contributing to increased crop yields and improved agricultural productivity.

Check Digit Verification of cas no

The CAS Registry Mumber 208665-95-6 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 2,0,8,6,6 and 5 respectively; the second part has 2 digits, 9 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 208665-95:
(8*2)+(7*0)+(6*8)+(5*6)+(4*6)+(3*5)+(2*9)+(1*5)=156
156 % 10 = 6
So 208665-95-6 is a valid CAS Registry Number.
InChI:InChI=1/C11H12BrNO/c1-8(2)7-14-11-4-3-9(6-13)5-10(11)12/h3-5,8H,7H2,1-2H3

208665-95-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-bromo-4-(2-methylpropoxy)benzonitrile

1.2 Other means of identification

Product number -
Other names 3-bromo-4-isobutoxybenzonitrile

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:208665-95-6 SDS

208665-95-6Relevant academic research and scientific papers

HCl·DMPU-assisted one-pot and metal-free conversion of aldehydes to nitriles

Hammond, Gerald B.,Mudshinge, Sagar R.,Potnis, Chinmay S.,Xu, Bo

, p. 4161 - 4164 (2020/07/14)

We report an efficient HCl·DMPU assisted one-pot conversion of aldehydes into nitriles. The use of HCl·DMPU as both an acidic source as well as a non-nucleophilic base constitutes an environmentally mild alternative for the preparation of nitriles. Our protocol proceeds smoothly without the use of toxic reagents and metal catalysts. Diverse functionalized aromatic, aliphatic and allylic aldehydes incorporating various functional groups were successfully converted to nitriles in excellent to quantitative yields. This protocol is characterized by a broad substrate scope, mild reaction conditions, and high scalability. This journal is

2 - (3-cyano-4-alkoxy) phenyl-4-substituted thiazole-5- formic acid class compound, composition and its preparation and use

-

, (2016/10/07)

The invention relates to a 2-(3-cyano-4-alkoxy) phenyl-4-substituted thiazole-5-formic acid compound which has xanthine oxidase inhibitory activity and is shown in a general formula I, a composition and preparation methods thereof. The invention also relates to applications of the compound and the composition thereof to preparation of medicaments for treating and/or preventing hyperuricemia and gout diseases. In the formula I, R2 is substituted or unsubstituted phenyl or a substituted or unsubstituted heteroaromatic radical, R1 is a substitutive aliphatic group of a straight chain or a branched chain, substituted or unsubstituted alicyclic hydrocarbonyl or substituted or unsubstituted aryl alkyl and A is an oxygen atom, a sulfur atom or a nitrogen atom.

PROCESS FOR THE PREPARATION OF 2-[3-CYANO-4-(2-METHYLPROPOXY)PHENYL]-4-METHYLTHIAZOLE-5-CARBOXYLIC ACID AND ITS PHARMACEUTICALLY ACCEPTABLE SALTS

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, (2011/12/02)

The present invention relates to novel and improved processes for the preparation of 2-[3-cyano-4-(2-methylpropoxy) phenyl]-4-methylthiazole-5-carboxylic acid compound of formula-1 and its pharmaceutically acceptable salts thereof. the present invention also provides the novel process for the preparation of crystalline forms of 2-[3-cyano-4-(2-methylpropoxy) phenyl]-4-methylthiazole-5-carboxylic acid compound of formula-1 and its intermediates.

A PROCESS FOR THE PREPARATION OF FEBUXOSTAT

-

Page/Page column 15, (2010/12/29)

The present invention relates to a process for the preparation of Febuxostat, useful in the pharmaceutical field for the treatment of the hyperuricemia.

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