61150-58-1

Basic information

• Product Name: 2-BROMO-4-FLUOROPHENYLACETONITRILE
• Synonyms: 2-BROMO-4-FLUOROPHENYLACETONITRILE;2-Bromo-4-fluorobenzeneacetonitrile
• CAS NO: 61150-58-1
• Molecular Formula: C₈H₅BrFN
• Molecular Weight: 214.03
• Mol File: 61150-58-1.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 281.0±25.0℃ (760 Torr)
• Flash Point: 123.8±23.2℃
• Appearance: /
• Density: 1.573±0.06 g/cm3 (20 ºC 760 Torr)
• Vapor Pressure: 0.00366mmHg at 25°C
• Refractive Index: 1.551
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 2-BROMO-4-FLUOROPHENYLACETONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-BROMO-4-FLUOROPHENYLACETONITRILE(61150-58-1)
• EPA Substance Registry System: 2-BROMO-4-FLUOROPHENYLACETONITRILE(61150-58-1)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 61150-58-1(Hazardous Substances Data)

Usage

General Description

2-Bromo-4-fluorophenylacetonitrile is a chemical compound with the molecular formula C8H5BrFN. It is a nitrile derivative, which means it contains a carbon triple-bonded to a nitrogen atom. 2-BROMO-4-FLUOROPHENYLACETONITRILE is commonly used as an intermediate in the synthesis of pharmaceuticals, agrochemicals, and other organic compounds. It is also used in the production of dyes, pigments, and other industrial chemicals. 2-Bromo-4-fluorophenylacetonitrile is a white to off-white solid with a slightly bitter taste and a faint, characteristic odor. It is considered to be moderately hazardous to human health and should be handled with care, following proper safety precautions.

InChI:InChI=1/C8H5BrFN/c9-8-5-7(10)2-1-6(8)3-4-11/h1-2,5H,3H2

Upstream product

• 61150-57-0 2-bromo-4-fluorobenzyl bromide 
• 143-33-9 sodium cyanide 
• 1422-53-3 2-bromo-4-fluorotoluene 
• 333-20-0 potassium thioacyanate 

Downstream Products

• 61150-59-2 2-(2-bromo-4-fluorophenyl)acetic acid 
• 65999-41-9 2-(2-bromo-4-fluorophenyl)acetamide 
• 56096-99-2 <2-(4-chlorophenylthio)-4-fluorophenyl>acetic acid 
• 1086599-47-4 2-(2-bromo-4-fluorophenyl)-2-methylpropanenitrile 
• 1086599-29-2 1-(2-bromo-4-fluorophenyl)cyclobutanecarbonitrile 
• 1012327-04-6 2-(2-bromo-4-fluorophenyl)-3,3-bis(methylthio)acrylonitrile 
• 1071838-67-9 C₁₁H₁₀FN 
• 1174642-55-7 C₁₆H₁₁BrFNOS 
• 1174642-15-9 (Z)-2-(2-bromo-4-fluorophenyl)-3-(4-methoxyphenyl)-3-methylthio-2-propenenitrile 
• 1174642-21-7 (Z)-2-(2-bromo-4-fluorophenyl)-3-methylthio-3-(3-pyridyl)-2-propenenitrile 
• 1174642-23-9 (Z)-2-(2-bromo-4-fluorophenyl)-3-(1-N-methyl-2-pyrrolyl)-3-methylthio-2-propenenitrile 
• 1350840-09-3 2-(2-bromo-4-fluorophenyl)-N-methoxyacetamide 
• 1361397-05-8 α-acetyl-2-bromo-4-fluorobenzene-acetonitrile 
• 1250021-16-9 1-(2-bromo-4-fluorophenyl)-2-propanone 

Relevant articles and documents

Highly diastereoselective synthesis of tetralin-fused spirooxindoles via lewis acid-catalyzed C(sp3)H bond functionalization

A highly diastereoselective synthesis of tetralin-fused spirooxindole derivatives was described. Treatment of benzylidene oxindoles with a catalytic amount of Sc(OTf)3 in refluxing hexane afforded the target compounds in good chemical yields with excellent diastereoselectivities (up to >20:1). Detailed investigation of the reaction mechanism revealed that both interconversion of the two diastereomers and their solubility difference in reaction medium were the key to achieving excellent diastereoselectivities.

Construction of 1,3-Dithio-Substituted Tetralins by [1,5]-Alkylthio Group Transfer Mediated Skeletal Rearrangement

A novel skeletal rearrangement involving a [1,5]-alkylthio group transfer/cyclization sequence is described. Treatment of benzylidene malonates having a thioketal moiety at the homobenzyl position with a catalytic amount of Sc(OTf)3 afforded alkylthio group rearranged adducts in good chemical yields. Detailed investigation of the reaction mechanism revealed that an intramolecular conjugate addition/ring opening sequence (not through-space transfer) is the key to achieving this reaction.

Synthesis of N-alkoxyindol-2-ones by copper-catalyzed intramolecular N-arylation of hydroxamates

The first example of copper-catalyzed intramolecular N-arylation of hydroxamic acid derivatives is presented. Based on this transformation a new method for the synthesis of N-alkoxyindol-2-ones from 2-(2-bromoaryl) acetylhydroxamates has been developed. T