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27005-52-3

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27005-52-3 Usage

General Description

2-Phenylindole-3-acetonitrile is a chemical compound with the molecular formula C16H12N2. It is a derivative of indole, containing a phenyl group attached to the third carbon atom and a nitrile group attached to the acetyl group. 2-PHENYLINDOLE-3-ACETONITRILE is commonly used in the synthesis of various organic compounds, including pharmaceuticals and agrochemicals. It exhibits anti-inflammatory and anti-fungal properties and has been studied for its potential applications in medicine. Additionally, it is used as a building block in organic synthesis for the preparation of heterocyclic compounds and has shown promising results in the development of new drugs.

Check Digit Verification of cas no

The CAS Registry Mumber 27005-52-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,7,0,0 and 5 respectively; the second part has 2 digits, 5 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 27005-52:
(7*2)+(6*7)+(5*0)+(4*0)+(3*5)+(2*5)+(1*2)=83
83 % 10 = 3
So 27005-52-3 is a valid CAS Registry Number.
InChI:InChI=1/C16H12N2/c17-11-10-14-13-8-4-5-9-15(13)18-16(14)12-6-2-1-3-7-12/h1-9,18H,10H2

27005-52-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(2-phenyl-1H-indol-3-yl)acetonitrile

1.2 Other means of identification

Product number -
Other names 2-phenyl-3-indolylacetonitrile

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:27005-52-3 SDS

27005-52-3Relevant articles and documents

Photoredox Cyanomethylation of Indoles: Catalyst Modification and Mechanism

O'Brien, Connor J.,Droege, Daniel G.,Jiu, Alexander Y.,Gandhi, Shivaani S.,Paras, Nick A.,Olson, Steven H.,Conrad, Jay

, p. 8926 - 8935 (2018/07/05)

The direct cyanomethylation of indoles at the 2- or 3-position was achieved via photoredox catalysis. The versatile nitrile synthon is introduced as a radical generated from bromoacetonitrile, a photocatalyst, and blue LED as a light source. The mechanism of the reaction is explored by determination of the Stern-Volmer quenching constants. By combining photophysical data and mass spectrometry to follow the catalyst decomposition, the catalyst ligands were tuned to enable synthetically useful yields of radical coupling products. A range of indole substrates with alkyl, aryl, halogen, ester, and ether functional groups participate in the reaction, affording products in 16-90% yields. The reaction allows the rapid construction of synthetically useful cyanomethylindoles, products that otherwise require several synthetic steps.

New MKLP-2 inhibitors in the paprotrain series: Design, synthesis and biological evaluations

Labrière, Christophe,Talapatra, Sandeep K.,Thoret, Sylviane,Bougeret, Cécile,Kozielski, Frank,Guillou, Catherine

, p. 721 - 734 (2016/02/09)

Members of the kinesin superfamily are involved in key functions during intracellular transport and cell division. Their involvement in cell division makes certain kinesins potential targets for drug development in cancer chemotherapy. The two most advanc

Synthesis of 2-Boryl- and silylindoles by copper-catalyzed borylative and silylative cyclization of 2-alkenylaryl isocyanides

Tobisu, Mamoru,Fujihara, Hirokazu,Koh, Keika,Chatani, Naoto

supporting information; experimental part, p. 4841 - 4847 (2010/10/19)

(Figure Presented) We have developed a method for the synthesis of 2-borylindoles via the copper(I)-catalyzed borylative cyclization of 2-alkenylphenyl isocyanides using diboronate. The reaction proceeds at room temperature under neutral conditions and exhibits high tolerance to functional groups, such as Br, CO2R, COR, CONMe2, and CN. The 2-borylindoles synthesized in the present study can be elaborated into an array of indole-based derivatives, for example, through the Suzuki-Miyaura reaction. The utility of this method is demonstrated in the rapid synthesis of a kinase inhibitor, paullone. The reaction can be extended to the synthesis of 2-hydride indole and 2-silylindole by using hydroboronate (or hydrosilane) and silylboronate, respectively. Under these copper-catalyzed conditions, a quinoxaline ring system can also be constructed by using 1,2-isocyanobenzene as a substrate.

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