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Ethanone, 2,2-difluoro-1-(2-thienyl)- (9CI), also known as 2,2-difluoro-1-(2-thienyl)ethanone, is an organic compound with the chemical formula C6H4F2OS. It is a colorless liquid with a molecular weight of 160.16 g/mol. Ethanone, 2,2-difluoro-1-(2-thienyl)- (9CI) is characterized by the presence of a difluoromethyl ketone group (CF2CO) and a 2-thienyl (thiophene) ring. It is synthesized by reacting 2-thiophenemagnesium bromide with difluoromethyl ketone. The compound has potential applications in the synthesis of pharmaceuticals and agrochemicals due to its unique structure and reactivity. It is important to handle Ethanone, 2,2-difluoro-1-(2-thienyl)- (9CI) with care, as it may have toxic or hazardous properties.

2991-99-3

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2991-99-3 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 2991-99-3 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,9,9 and 1 respectively; the second part has 2 digits, 9 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 2991-99:
(6*2)+(5*9)+(4*9)+(3*1)+(2*9)+(1*9)=123
123 % 10 = 3
So 2991-99-3 is a valid CAS Registry Number.

2991-99-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 2,2-difluoro-1-(thiophen-2-yl)ethan-1-one

1.2 Other means of identification

Product number -
Other names 2,2-Difluoro-1-thiophen-2-yl-ethanone

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:2991-99-3 SDS

2991-99-3Relevant academic research and scientific papers

Transaminases as suitable catalysts for the synthesis of enantiopure β,β-difluoroamines

García-Ramos, Marina,Lavandera, Iván

, p. 984 - 988 (2022/02/16)

Transaminases have shown the ability to catalyze the amination of a series of aliphatic and (hetero)aromatic α,α-difluorinated ketones with high stereoselectivity, thus providing the corresponding β,β-difluoroamines in high isolated yields (55–82%) and ex

Biocatalytic Strategy for the Highly Stereoselective Synthesis of CHF2-Containing Trisubstituted Cyclopropanes

Carminati, Daniela M.,Decaens, Jonathan,Couve-Bonnaire, Samuel,Jubault, Philippe,Fasan, Rudi

supporting information, p. 7072 - 7076 (2021/02/27)

The difluoromethyl (CHF2) group has attracted significant attention in drug discovery and development efforts, owing to its ability to serve as fluorinated bioisostere of methyl, hydroxyl, and thiol groups. Herein, we report an efficient biocat

Direct and Chemoselective Synthesis of Tertiary Difluoroketones via Weinreb Amide Homologation with a CHF2-Carbene Equivalent

Miele, Margherita,Citarella, Andrea,Micale, Nicola,Holzer, Wolfgang,Pace, Vittorio

supporting information, p. 8261 - 8265 (2019/10/16)

The homologation of Weinreb amides into difluoromethylketones with a formal nucleophilic CHF2 transfer agent is reported. Activating TMSCHF2 with potassium tert-amylate enables a convenient access to the difluorinated homologation re

Difluoromethylation of carboxylic acids via the addition of difluorinated phosphorus ylide to acyl chlorides

Trifonov, Alexey L.,Levin, Vitalij V.,Struchkova, Marina I.,Dilman, Alexander D.

supporting information, p. 5304 - 5307 (2017/11/06)

A one-step protocol for the difluoromethylation of carboxylic acids is described. The reaction involves the interaction of intermediate acyl chlorides with in situ generated difluorinated phosphorus ylide Ph3P=CF2. Aromatic acids can be selectively transformed within one step either to bis-difluoromethylated alcohols or to difluorinated ketones depending on the particular reaction conditions. For bulky α-branched carboxylic acids, only ketones are produced.

Practical Access to Difluoromethyl Ketones via Straightforward Decarboxylative Difluorination of β-Ketoacids

Li, Yin-Long,Li, Jian,Deng, Jun

, p. 1407 - 1412 (2017/04/18)

A facile synthetic approach to a series of difluoromethyl ketones from β-ketoacids has been described. This transformation is achieved through the straightforward decarboxylative difluorination of β-ketoacids in the absence of any catalyst. Furthermore, the resulted difluoromethyl ketones can be easily converted into corresponding difluoromethylated building blocks for pharmaceuticals and materials. (Figure presented.).

Synthesis of Difluoromethyl Ketones from Weinreb Amides, and Tandem Addition/Cyclization of o-Alkynylaryl Weinreb Amides

Phetcharawetch, Jongkonporn,Betterley, Nolan M.,Soorukram, Darunee,Pohmakotr, Manat,Reutrakul, Vichai,Kuhakarn, Chutima

supporting information, p. 6840 - 6850 (2017/12/26)

[Difluoro(phenylsulfanyl)methyl]trimethylsilane (PhSCF2SiMe3) underwent a fluoride-induced nucleophilic addition to the carbonyl group of Weinreb amides to provide the corresponding difluoro(phenylsulfanyl)methyl ketones. These were

One-pot synthesis of difluoromethyl ketones by a difluorination/fragmentation process

Leng, Daniel J.,Black, Conor M.,Pattison, Graham

supporting information, p. 1531 - 1535 (2016/02/10)

Difluoromethyl ketones are an under-studied class of ketones which have great potential as useful building blocks for materials and drug design. Here we report a simple and convenient synthesis of this class of compounds via a one-pot difluorination/fragm

In Situ Generated Fluorinated Iminium Salts for Difluoromethylation and Difluoroacetylation

Schmitt, Etienne,Rugeri, Baptiste,Panossian, Armen,Vors, Jean-Pierre,Pazenok, Sergii,Leroux, Frédéric R.

supporting information, p. 4510 - 4513 (2015/09/28)

The use of TFEDMA, a fluoroalkyl amino reagent, for the difluoromethylation and difluoroacylation of arenes, heteroarenes, and C-H acidic compounds is reported. This approach allows for an efficient access to difluoromethylated products of high added valu

Facile preparation of di- and monofluoromethyl ketones from trifluoromethyl ketones via fluorinated enol silyl ethers

Surya Prakash,Hu,Olah

, p. 357 - 362 (2007/10/03)

Di- and monofluoromethyl ketones were prepared from the readily available trifluoromethyl ketones in high yields. Magnesium metal mediated reductive defluorination readily generates fluorinated enol silyl ethers, which upon fluoride or acid assisted hydrolysis give the respective ketones in good to excellent yields.

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