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5219-61-4

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5219-61-4 Usage

Description

PHENYLTHIOACETONITRILE, also known as Thiophenol Acetonitrile, is an electron-deficient aromatic compound that undergoes vicarious nucleophilic substitution (VNS) reactions with the anion. It is a clear colorless to light yellow liquid and is equivalent to an acetonitrile anion synthon with thiophenate as the leaving group.

Uses

Used in Chemical Synthesis:
PHENYLTHIOACETONITRILE is used as a synthetic intermediate for the production of various organic compounds. Its electron-deficient nature allows it to participate in VNS reactions, making it a versatile building block in the synthesis of pharmaceuticals, agrochemicals, and other specialty chemicals.
Used in Pharmaceutical Industry:
PHENYLTHIOACETONITRILE is used as a key component in the synthesis of certain pharmaceuticals. Its ability to undergo VNS reactions with the anion makes it a valuable precursor for the development of new drugs with potential therapeutic applications.
Used in Agrochemical Industry:
PHENYLTHIOACETONITRILE is used as a starting material for the synthesis of various agrochemicals, such as pesticides and herbicides. Its reactivity in VNS reactions enables the creation of novel compounds with improved efficacy and selectivity in controlling pests and weeds.
Used in Research and Development:
PHENYLTHIOACETONITRILE is used as a research compound for studying the mechanisms of VNS reactions and exploring new synthetic routes to various organic molecules. Its unique properties make it an important tool in the development of new chemical processes and methodologies.

Check Digit Verification of cas no

The CAS Registry Mumber 5219-61-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,2,1 and 9 respectively; the second part has 2 digits, 6 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 5219-61:
(6*5)+(5*2)+(4*1)+(3*9)+(2*6)+(1*1)=84
84 % 10 = 4
So 5219-61-4 is a valid CAS Registry Number.
InChI:InChI=1/C8H7NS/c9-6-7-10-8-4-2-1-3-5-8/h1-5H,7H2

5219-61-4 Well-known Company Product Price

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  • (Code)Product description
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  • TCI America

  • (P1602)  (Phenylthio)acetonitrile  >98.0%(GC)

  • 5219-61-4

  • 5g

  • 495.00CNY

  • Detail
  • Alfa Aesar

  • (A12869)  (Phenylthio)acetonitrile, 98%   

  • 5219-61-4

  • 5g

  • 644.0CNY

  • Detail
  • Alfa Aesar

  • (A12869)  (Phenylthio)acetonitrile, 98%   

  • 5219-61-4

  • 25g

  • 1504.0CNY

  • Detail
  • Alfa Aesar

  • (A12869)  (Phenylthio)acetonitrile, 98%   

  • 5219-61-4

  • 100g

  • 5443.0CNY

  • Detail

5219-61-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name (Phenylthio)acetonitrile

1.2 Other means of identification

Product number -
Other names 2-phenylsulfanylacetonitrile

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:5219-61-4 SDS

5219-61-4Relevant articles and documents

Transition-metal-free decarboxylative thiolation of stable aliphatic carboxylates

Xing, Wei-Long,Liu, De-Guang,Fu, Ming-Chen

, p. 4593 - 4597 (2021/02/03)

A transition-metal-free decarboxylative thiolation protocol is reported in which primary, secondary, tertiary (hetero)aryl acetates and α-CN substituted acetates undergo the decarboxylative thiolation smoothly, to deliver a variety of functionalized aryl alkyl sulfides in moderate to excellent yields. Aryl diselenides are also amenable substrates for construction of C-Se bonds under the simple and mild reaction conditions. Moreover, the protocol is successfully applied to the late-stage modification of pharmaceutical carboxylates with satisfactory chemoselectivity and functional-group compatibility. This journal is

Sulfoxide Reduction/C(sp3)-S Metathesis Cascade in Ionic Liquid

Liu, Chenjing,Chen, Dengfeng,Fu, Yuanyuan,Wang, Fei,Luo, Jinyue,Huang, Shenlin

supporting information, p. 5701 - 5705 (2020/07/24)

A sulfoxide reduction/C-S bond metathesis cascade between sulfoxides and alkyl bromides has been developed to access high-value sulfides without the use of any catalysts or bases. In this cascade, classical Kornblum oxidation is employed to reduce sulfoxides with alkyl bromides in ionic liquid. This protocol features high functional tolerance, mild conditions, promising scalability, and sustainable solvents.

Rhodium-Catalyzed Rearrangement of S/Se-Ylides for the Synthesis of Substituted Vinylogous Carbonates

Reddy, Angula Chandra Shekar,Anbarasan, Pazhamalai

supporting information, p. 9965 - 9969 (2019/12/24)

An efficient rhodium-catalyzed unprecedented oxa-[2,3]-sigmatropic rearrangement of sulfur ylide derived from α-thioesters/ketones and diazo carbonyl compounds has been accomplished for the synthesis of various sulfur-tethered vinylogous carbonates in good to excellent yields. Important features of the developed reaction include wide functional group tolerance, excellent chemo- and regioselectivity, and efficient rearrangement involving the carbonyl motif. The present reaction also equally works well with α-selenoesters for the synthesis of seleno-containing vinylogous carbonates.

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