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2,2-Difluoro-2-(4-fluorophenyl)acetic Acid, with the CAS number 94010-78-3, is an organic compound characterized by the presence of two fluorine atoms and a 4-fluorophenyl group attached to an acetic acid backbone. This unique molecular structure endows it with specific chemical properties that make it valuable in various applications.

94010-78-3

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94010-78-3 Usage

Uses

Used in Organic Synthesis:
2,2-Difluoro-2-(4-fluorophenyl)acetic Acid is utilized as a key intermediate in the synthesis of various organic compounds. Its distinctive structure allows it to participate in a range of chemical reactions, facilitating the creation of new molecules with potential applications in pharmaceuticals, agrochemicals, and other specialty chemicals.
Used in Pharmaceutical Industry:
In the pharmaceutical sector, 2,2-Difluoro-2-(4-fluorophenyl)acetic Acid serves as a building block for the development of new drugs. Its fluorinated nature can impart specific biological activities to the resulting compounds, making it a valuable component in the design of novel therapeutic agents.
Used in Agrochemical Industry:
Similarly, in the agrochemical industry, 2,2-Difluoro-2-(4-fluorophenyl)acetic Acid is employed as a precursor for the synthesis of new pesticides or herbicides. The incorporation of fluorine atoms can enhance the lipophilicity and metabolic stability of these compounds, potentially leading to improved performance in agricultural applications.
Used in Specialty Chemicals:
2,2-Difluoro-2-(4-fluorophenyl)acetic Acid also finds use in the production of specialty chemicals, such as advanced materials or fine chemicals, where its unique properties can contribute to the development of innovative products with specific performance characteristics.

Check Digit Verification of cas no

The CAS Registry Mumber 94010-78-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,4,0,1 and 0 respectively; the second part has 2 digits, 7 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 94010-78:
(7*9)+(6*4)+(5*0)+(4*1)+(3*0)+(2*7)+(1*8)=113
113 % 10 = 3
So 94010-78-3 is a valid CAS Registry Number.

94010-78-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,2-Difluoro-2-(4-fluorophenyl)acetic Acid

1.2 Other means of identification

Product number -
Other names |A,|A,4-Trifluorobenzeneacetic Acid

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:94010-78-3 SDS

94010-78-3Relevant academic research and scientific papers

Copper-catalyzed cascade radical cyclization of alkynoates: Construction of aryldifluoromethylated coumarins

Chen, Zhiwei,Huang, Xiaoxiao,Tang, Wei,Zeng, Piaopiao

supporting information, p. 10223 - 10227 (2021/12/10)

A mild and simple method is reported for the construction of 3-difluoroarylmethylated coumarins using α,α-difluoroarylacetic acids as an easily handled difluoromethyl source in reaction with ester 3-arylpropiolates under the promotion of copper. The reaction involves a proposed radical-triggered domino decarboxylative aryldifluoromethylation/5-exo cyclization/ester migration process that directly forms Csp2-CF2Ar and C-C bonds with good functional group tolerance. This journal is

Silver-catalyzed decarboxylative radical allylation of α,α-difluoroarylacetic acids for the construction of CF2-allyl bonds

Wang, Pingyang,Du, Pengcheng,Sun, Qianqian,Zhang, Jianhua,Deng, Hongmei,Jiang, Haizhen

, p. 2023 - 2029 (2021/03/16)

An efficient silver-catalyzed method of decarboxylative radical allylation of α,α-difluoroarylacetic acids to build CF2-allyl bonds has been developed. Using allylsulfone as an allyl donor, α,α-difluorine substituted arylacetic acids bearing various functional groups are successfully allylated to access a series of 3-(α,α-difluorobenzyl)-1-propylene compounds in moderate to excellent yields in aqueous CH3CN solution under the mild conditions. Experimental studies disclosed that the α-fluorine substitution of arylacetic acid has a great influence on free radical activity and reactivity.

Synthetic method of aromatic ring group or aromatic heterocyclic tetrazole

-

Paragraph 0055-0062; 0065, (2020/12/30)

The synthetic method comprises the following steps: (1) reacting 1.0 eq of ArI or HArI with 1.2 eq of ethyl 2, 2-difluoroacetate in the presence of DMSO as a solvent and 4.0 eq of Cu under the protection of nitrogen at 30 DEG C and 50 DEG C, and purifying to obtain a first intermediate compound; (2) dissolving 1.0 eq of the first intermediate compound in a mixed solvent of THF and water, adding 2.0 eq of LiOH, reacting at room temperature for 2 hours, spin-drying the solvent, adding HCl until the pH value is equal to 3, and filtering to obtain a second intermediate compound; and (3) reacting 1.0 eq of the second intermediate compound with 2.0 eq of diphenyl azide phosphate in the presence of 2.5 eq of triethylamine by taking tert-butyl alcohol as a solvent to generate aromatic ring group or aromatic heterocyclic tetrazole. The invention provides a novel synthetic method of aromatic ring group or aromatic heterocyclic tetrazole, wherein a target compound can be more conveniently obtained, and reagents participating in the reaction are low in toxicity, mild in reaction condition, simple and safe in aftertreatment, good in product quality and suitable for large-scale production.

Fe(III)-Catalyzed Decarboxylative C3-Difluoroarylmethylation of Coumarins with α,α-Difluoroarylacetic Acids

Chen, Zhiwei,Bai, Xiang,Sun, Jie,Xu, Yicheng

supporting information, p. 7674 - 7682 (2020/07/15)

A facile Fe(III)-catalyzed oxidative decarboxylative radical coupling reaction of α,α-difluoroarylacetic acids with coumarins has been developed. This transformation, which provides a series of C-3 difluoroarylmethylated coumarins containing various functional groups in moderate-to-good yields, features easily accessible starting materials and operational simplicity.

Silver-Catalyzed Decarboxylative Alkynylation of α,α-Difluoroarylacetic Acids with Ethynylbenziodoxolone Reagents

Chen, Fei,Hashmi, A. Stephen K.

supporting information, p. 2880 - 2882 (2016/07/06)

A decarboxylating alkynylation of α,α-difluoroarylacetic acids with ethynylbenziodoxolone reagents is reported. AgNO3 serves as the catalyst and K2S2O8 as the oxidant. A series of functional groups were tolerated, and moderate to good yields were obtained.

Easy Access to Difluoromethylene-Containing Arene Analogues through Palladium-Catalysed C–H Olefination

Shao, Changdong,Shi, Guangfa,Zhang, Yanghui

, p. 5529 - 5538 (2016/11/25)

An efficient palladium-catalysed ortho-C–H olefination of α,α-difluorophenylacetic acid derivatives using 8-aminoquinoline as a bidentate directing group has been developed. A range of olefinated arenes can thus be synthesized in a concise way. This reaction provides an easy and straightforward route to a panel of difluoromethylated arene analogues in moderate to good yields, with a satisfactory tolerance of common functional groups. Transformation of the products into a variety of other difluoromethylene-containing compounds demonstrates the utility of this method.

ADENOSINE A3 RECEPTOR MODULATING COMPOUNDS AND METHODS OF USE THEREOF

-

, (2012/03/12)

Provided herein is a method of preventing, treating, or ameliorating one or more symptoms of an adenosine A3-mediated condition, disorder, or disease, with a compound of Formula I. Also provided herein is a method of preventing, treating, or ameliorating one or more symptoms of glaucoma or ocular hypertension. Further provided herein is a method of modulating the activity of an adenosine A3 receptor.

Fluorination of 2-oxo-ethane derivatives with diethylaminosulfur trifluoride (DAST)

Haegele, Gerhard,Haas, Andreas

, p. 15 - 19 (2007/10/03)

The fluorination of 2-oxo-ethane derivatives with DAST is described. The use of Znl2 as a catalyst improves the yield in the fluorination of 2-phenyl-2-oxo-acetonitrile with DAST.

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