217661-27-3

Basic information

• Product Name: 2-CYANO-4-FLUOROBENZYL BROMIDE
• Synonyms: 2-(broMoMethyl)-5-fluorobenzonitrile;2-CYANO-4-FLUOROBENZYL BROMIDE
• CAS NO: 217661-27-3
• Molecular Formula: C₈H₅BrFN
• Molecular Weight: 214.0344
• Mol File: 217661-27-3.mol
• Article Data: 13

Chemical Properties

• Melting Point: 64.9-65.9 °C
• Boiling Point: 263.576 °C at 760 mmHg
• Flash Point: 113.207 °C
• Appearance: /
• Density: 1.591 g/cm³
• Vapor Pressure: 0.01mmHg at 25°C
• Refractive Index: 1.564
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• CAS DataBase Reference: 2-CYANO-4-FLUOROBENZYL BROMIDE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CYANO-4-FLUOROBENZYL BROMIDE(217661-27-3)
• EPA Substance Registry System: 2-CYANO-4-FLUOROBENZYL BROMIDE(217661-27-3)

Safety Data

• Hazardous Substances Data: 217661-27-3(Hazardous Substances Data)

Usage

General Description

2-Cyano-4-Fluorobenzyl Bromide is a chemical compound that falls into the category of organic halides. It's known for its unique structural composition with a molecular formula of C8H5BrFN and a molecular weight of 211.03 g/mol. Its systematic name is 4-Bromo-1-(4-fluorophenyl)-2-butanone. As a chemical reagent, it is often used in the creation of pharmaceutical products and in various chemical reactions within the realm of organic chemistry. 2-CYANO-4-FLUOROBENZYL BROMIDE should be handled with caution due to its potent reactivity. It can cause burns and eye damage, and should be used only in a controlled laboratory environment adhering to necessary safety precautions. The compound is not naturally occurring and is instead synthesized through various chemical procedures.

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

Upstream product

• 77532-79-7 3-fluoro-6-methylbenzonitrile 

Downstream Products

• 1432519-32-8 (6R,7R)-8,8-bis(benzenesulfonyl)-13-fluoro-6-{[(1R,2S,5R)-5-methyl-2-(propan-2-yl)cyclohexyl]oxy}-5-oxatricyclo[8.4.0.0]tetradeca-1⁽¹⁴⁾,2,10,12-tetraen-4-one 
• 1432519-35-1 (2Z)-2-({2-[2,2-bis(benzenesulfonyl)ethyl]-5-fluorophenyl}methyl)but-2-ene-1,4-diol 

Relevant articles and documents

INHIBITORS OF MUTANT ISOCITRATE DEHYDROGENASES AND COMPOSITIONS AND METHODS THEREOF

The invention provides novel chemical compounds useful for treating cancer, or a related disease or disorder thereof, and pharmaceutical composition and methods of preparation and use thereof.

Substituted 5,6,11,12-tetradehydrodibenzo[ a, e ]cyclooctenes: Syntheses, properties, and DFT studies of substituted sondheimer-wong diynes

Highly strained cyclic acetylenes 5,6,11,12-tetradehydrodibenzo[a,e]cyclooctenes (Sondheimer-Wong diynes) having various substituents on their benzene rings were synthesized successfully by one-pot treatment of the corresponding formyl sulfones with diethyl chlorophosphate/lithium hexamethyldisilazide (LiHMDS) and then lithium diisopropylamide (LDA). When mixtures of two types of formyl sulfones bearing different substituents were subjected to this protocol, the unsymmetrically substituted Sondheimer-Wong diynes could be synthesized in a stepwise manner by isolation of the heterocoupled vinyl sulfone intermediates followed by their treatment with LDA. The UV-vis absorption spectra and cyclic voltammograms of the substituted Sondheimer-Wong diynes were recorded. The electronic effect of substituents on the diynes was investigated in their click reactions and nucleophilic and electrophilic additions.

Copper-catalyzed benzylic C-H oxygenation under an oxygen atmosphere via N-H imines as an intramolecular directing group

Copper-catalyzed benzylic C-H oxygenation under an oxygen atmosphere was developed starting from carbonitriles and Grignard reagents via N-H imine intermediates. The present process is characterized by the following two-step sequence in a one-pot manner: (1) addition of Grignard reagents to carbonitriles to form N-H imines and (2) benzylic C-H oxygenation (C=O bond formation) triggered by 1,5-hydrogen atom transfer with transient iminyl copper species.