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1-Chloro-3-(pentafluoroethyl)benzene is an organic compound with the molecular formula C8H3ClF5. It is a colorless liquid at room temperature and is characterized by its unique structure, which includes a benzene ring with a chlorine atom at the 1-position and a pentafluoroethyl group at the 3-position. 1-chloro-3-(pentafluoroethyl)benzene is known for its high chemical stability and resistance to thermal decomposition, making it a valuable intermediate in the synthesis of various pharmaceuticals, agrochemicals, and specialty chemicals. Due to its fluorinated nature, it also exhibits interesting properties such as low surface tension and high electronegativity, which can be exploited in various applications. The compound is typically synthesized through electrophilic aromatic substitution reactions and is used in the preparation of more complex molecules that require a fluorinated aromatic core.

309-13-7

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309-13-7 Usage

Chemical Structure

Chlorinated derivative of benzene with a pentafluoroethyl group attached to the benzene ring

Functional Groups

Chlorine atom, pentafluoroethyl group

Molecular Weight

216.57 g/mol

Physical State

Liquid at room temperature

Color

Colorless to light yellow liquid

Boiling Point

Not specified, but expected to be higher than benzene due to the presence of fluorine and chlorine atoms

Melting Point

Not specified, but expected to be lower than benzene due to the presence of fluorine and chlorine atoms

Density

Not specified, but expected to be higher than benzene due to the presence of fluorine and chlorine atoms

Solubility

Soluble in organic solvents like dichloromethane, acetone, and ethyl acetate

Reactivity

Reacts with nucleophiles, can undergo electrophilic substitution reactions

Uses

Building block in the synthesis of various organic compounds, used in pharmaceutical and agrochemical industries for the production of herbicides, insecticides, and pharmaceutical intermediates

Safety Precautions

Proper handling and disposal procedures should be followed due to its chlorinated nature to ensure safety and environmental protection

Environmental Impact

Potential environmental concerns due to its chlorinated nature, but specific impact not specified in the material provided

Industrial Applications

Wide range of potential applications in various industries, including pharmaceuticals, agrochemicals, and chemical synthesis

Research and Development

Ongoing research to develop new molecules with potential applications in a range of industries, taking advantage of its unique structure and properties

Check Digit Verification of cas no

The CAS Registry Mumber 309-13-7 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 3,0 and 9 respectively; the second part has 2 digits, 1 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 309-13:
(5*3)+(4*0)+(3*9)+(2*1)+(1*3)=47
47 % 10 = 7
So 309-13-7 is a valid CAS Registry Number.

309-13-7Relevant academic research and scientific papers

Fluoride ion-catalyzed 1,2-desilylative defluorination: Syntheses of 1-substituted 2,2-difluorostyrenes

Nakamura, Yutaka,Uneyama, Kenji

, p. 5894 - 5897 (2007)

(Chemical Equation Presented) 1-(3′-Chlorophenyl)-1-trimethylsilyl-1, 2,2,2-tetrafluoroethane has been prepared in an excellent yield by the Mg-promoted defluorinative silylation of 3-chloropentafluoroethylbenzene and transformed to a series of 1-substitu

A class of effective decarboxylative perfluoroalkylating reagents: [(phen)2Cu](O2CRF)

Huang, Yangjie,Ajitha, Manjaly J.,Huang, Kuo-Wei,Zhang, Zhongxing,Weng, Zhiqiang

supporting information, p. 8468 - 8474 (2016/06/01)

This article describes the invention of a class of effective reagents [(phen)2Cu](O2CRF) (1) for the decarboxylative perfluoroalkylation of aryl and heteroaryl halides. Treatment of copper tert-butyloxide with phenanthroline ligands, with subsequent addition of perfluorocarboxylic acids afforded air-stable copper(i) perfluorocarboxylato complexes 1. These complexes reacted with a variety of aryl and heteroaryl halides to form perfluoroalkyl(hetero)arenes in moderate to high yields. Computational studies suggested that the coordination of the second phen ligand may reduce the energy barrier for the decarboxylation of perfluorocarboxylate to facilitate perfluoroalkylation.

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