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Ethanone, 1-(6-fluoro-3-pyridinyl)(9CI), is a chemical compound characterized by the molecular formula C7H6FNO. It is a derivative of ethanone, featuring a 6-fluoro-3-pyridinyl group attached to its structure. Ethanone, 1-(6-fluoro-3-pyridinyl)(9CI) is of interest to chemists and researchers due to its potential applications in various fields, including the synthesis of pharmaceuticals and agrochemicals, as well as in research and development within organic and medicinal chemistry.

84331-14-6

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84331-14-6 Usage

Uses

Used in Pharmaceutical Synthesis:
Ethanone, 1-(6-fluoro-3-pyridinyl)(9CI) is utilized as a key intermediate in the synthesis of pharmaceuticals. Its unique structure allows for the development of new drugs with potential therapeutic benefits.
Used in Agrochemical Synthesis:
Ethanone, 1-(6-fluoro-3-pyridinyl)(9CI) also serves as an important building block in the creation of agrochemicals, contributing to the development of effective products for agricultural applications.
Used in Research and Development:
Ethanone, 1-(6-fluoro-3-pyridinyl)(9CI) is employed in research and development within the fields of organic chemistry and medicinal chemistry. Its properties and potential uses are being explored to advance scientific understanding and innovation in these areas.
Used in Organic Chemistry:
In the realm of organic chemistry, Ethanone, 1-(6-fluoro-3-pyridinyl)- (9CI) is used as a reagent or starting material for various chemical reactions, enabling the synthesis of complex organic molecules with specific properties and functions.
Used in Medicinal Chemistry:
Ethanone, 1-(6-fluoro-3-pyridinyl)(9CI) is also utilized in medicinal chemistry for the design and synthesis of novel bioactive molecules. Its incorporation into drug candidates can potentially lead to the discovery of new therapeutic agents with improved efficacy and selectivity.

Check Digit Verification of cas no

The CAS Registry Mumber 84331-14-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 8,4,3,3 and 1 respectively; the second part has 2 digits, 1 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 84331-14:
(7*8)+(6*4)+(5*3)+(4*3)+(3*1)+(2*1)+(1*4)=116
116 % 10 = 6
So 84331-14-6 is a valid CAS Registry Number.
InChI:InChI=1/C7H6FNO/c1-5(10)6-2-3-7(8)9-4-6/h2-4H,1H3

84331-14-6SDS

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 1-(6-Fluoropyridin-3-yl)ethanone

1.2 Other means of identification

Product number -
Other names ETHANONE,1-(6-FLUORO-3-PYRIDINYL)

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:84331-14-6 SDS

84331-14-6Relevant academic research and scientific papers

Modular Synthesis of Alkenyl Sulfamates and β-Ketosulfonamides via Sulfur(VI) Fluoride Exchange (SuFEx) Click Chemistry and Photomediated 1,3-Rearrangement

Sousa E Silva, Felipe Cesar,Doktor, Katarzyna,Michaudel, Quentin

supporting information, p. 5271 - 5276 (2021/07/20)

Herein, we report a synthesis of medicinally relevant β-ketosulfonamides via a photomediated 1,3-rearrangement of alkenyl sulfamates. This protocol tolerates a wide array of sensitive functional groups including alkenes, alkynes, and nitrogen-based heterocycles. Additionally, this work provides a general approach toward alkenyl sulfamates via a two-step Sulfur(VI) Fluoride Exchange (SuFEx) sequence capitalizing on SO2F2 as a linchpin to efficiently couple readily available ketones and amines without a large excess of either partner.

Nucleophilic Fluorination of Heteroaryl Chlorides and Aryl Triflates Enabled by Cooperative Catalysis

Hong, Cynthia M.,Whittaker, Aaron M.,Schultz, Danielle M.

, p. 3999 - 4006 (2021/03/09)

Aryl and heteroaryl fluorides are growing to be dominant motifs in pharmaceuticals and agrochemicals, yet they are rare in both nature and commodity chemicals. As a consequence, there is an increasingly urgent need to develop mild, cost-effective, and scalable methods for fluorination. The most straightforward route to synthesize aryl fluorides is through the halide exchange "halex"reaction, but conditions, cost, and atom economy preclude most available methods from large-scale manufacturing processes. We report a new approach that leverages the cooperative action of 18-crown-6 ether and tetramethylammonium chloride to catalytically access the reactivity of tetramethylammonium fluoride and achieve halex fluorinations under mild conditions with operational ease. The described methodology readily converts both heteroaryl chlorides and aryl triflates to their corresponding (hetero)aryl fluorides in high yields and purities.

BTK INHIBITOR

-

Paragraph 1251-1252, (2017/11/16)

Provided are a series of BTK inhibitors, and specifically disclosed are a compound, pharmaceutically acceptable salt thereof, tautomer thereof or prodrug thereof represented by formula (I), (II), (III) or (IV).

Asymmetric Biocatalytic Synthesis of Fluorinated Pyridines through Transesterification or Transamination: Computational Insights into the Reactivity of Transaminases

López-Iglesias, María,González-Martínez, Daniel,Rodríguez-Mata, María,Gotor, Vicente,Busto, Eduardo,Kroutil, Wolfgang,Gotor-Fernández, Vicente

, p. 279 - 291 (2017/02/05)

The synthesis of a family of pyridines bearing a fluorinated substituent on the aromatic ring has been carried out through two independent and highly stereoselective chemoenzymatic strategies. Short chemical synthetic routes toward fluorinated racemic amines and prochiral ketones have been developed, which served as substrates to explore the suitability of lipases and transaminases in asymmetric biotransformations. The lipase-catalyzed kinetic resolution via acylation of racemic amines proceeded smoothly giving conversions close to 50% and excellent enantioselectivities. Alternatively, the biotransamination of the corresponding prochiral ketones was investigated giving access to both optically pure amine enantiomers using transaminases with complementary selectivity. High to quantitative conversion values were achieved, which allowed the isolation of the amines in moderate to high yields (40–88%). A deeper understanding of the latter process was enabled by performing theoretical calculations on thermodynamic and mechanistic aspects. Calculations showed that the biotransamination reactions are highly favoured by the presence of fluorine atoms and the pyridine ring. (Figure presented.).

PYRAZOLYLAMINOPYRIDINE DERIVATIVES USEFUL AS KINASE INHIBITORS

-

Page/Page column 116, (2008/06/13)

This invention relates to novel compounds having the Formula (I) to their pharmaceutical compositions and to their methods of use. These novel compounds provide a treatment for cancer.

ARALKYLAMINOETHANOL HETEROCYCLIC COMPOUNDS

-

, (2008/06/13)

Heterocyclic aminoethanols of the formula: Het--CHOH--CH 2--NH-aralkylwhere Het is a 6-10 membered N-heterocycle are disclosed. The compounds are useful as pharmaceuticals.

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