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Ethanone,1-(2-fluoro-4-pyridinyl)-, also known as 2-Fluoro-4-pyridinol, is a chemical compound with the molecular formula C7H6FN2O. It is a colorless to light yellow liquid with a molecular weight of 142.14 g/mol. Ethanone,1-(2-fluoro-4-pyridinyl)is known for its strong odor and should be handled with care due to its potential health hazards.

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  • 111887-72-0 Structure
  • Basic information

    1. Product Name: Ethanone,1-(2-fluoro-4-pyridinyl)-
    2. Synonyms: 1-(2-fluoropyridin-4-yl)ethanone;Ethanone,1-(2-fluoro-4-pyridinyl)-;Ethanone, 1-(2-fluoro-4-pyridinyl)- (9CI)
    3. CAS NO:111887-72-0
    4. Molecular Formula: C7H6FNO
    5. Molecular Weight: 139.1270432
    6. EINECS: N/A
    7. Product Categories: PYRIDINE;ACETYLGROUP
    8. Mol File: 111887-72-0.mol
  • Chemical Properties

    1. Melting Point: 37.5-39.0 °C
    2. Boiling Point: 231.6±20.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.175±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. PKA: -2.13±0.10(Predicted)
    10. CAS DataBase Reference: Ethanone,1-(2-fluoro-4-pyridinyl)-(CAS DataBase Reference)
    11. NIST Chemistry Reference: Ethanone,1-(2-fluoro-4-pyridinyl)-(111887-72-0)
    12. EPA Substance Registry System: Ethanone,1-(2-fluoro-4-pyridinyl)-(111887-72-0)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 111887-72-0(Hazardous Substances Data)

111887-72-0 Usage

Uses

Used in Pharmaceutical Industry:
Ethanone,1-(2-fluoro-4-pyridinyl)is used as a key intermediate in the synthesis of various pharmaceuticals. Its unique structure allows it to be incorporated into a wide range of drug molecules, making it a valuable component in the development of new medications.
Used in Agrochemical Industry:
In the agrochemical industry, Ethanone,1-(2-fluoro-4-pyridinyl)is utilized in the production of pesticides and herbicides. Its chemical properties make it suitable for the development of effective and targeted agricultural chemicals.
Used in Organic Chemistry:
Ethanone,1-(2-fluoro-4-pyridinyl)is also used as an intermediate in the synthesis of other organic compounds. Its versatility in chemical reactions allows it to be a valuable building block in the creation of various organic molecules for different applications.

Check Digit Verification of cas no

The CAS Registry Mumber 111887-72-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,1,1,8,8 and 7 respectively; the second part has 2 digits, 7 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 111887-72:
(8*1)+(7*1)+(6*1)+(5*8)+(4*8)+(3*7)+(2*7)+(1*2)=130
130 % 10 = 0
So 111887-72-0 is a valid CAS Registry Number.

111887-72-0SDS

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-(2-fluoropyridin-4-yl)ethanone

1.2 Other means of identification

Product number -
Other names 1-(2-Fluoro-4-pyridyl)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:111887-72-0 SDS

111887-72-0Relevant articles and documents

Casein kinase 1 (CK1) inhibitor for plants (by machine translation)

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Paragraph 0053; 0104; 0109-0112; 0117, (2020/02/14)

[Problem] to provide various lead compounds PHA derivatives, and/or circadian rhythm control agent having stronger CK1 inhibitor activity. [Solution] a compound represented by formula I, or a salt thereof or a solvate thereof. (R1 The, H or C1 - 5 A straight-chain, branched or cyclic alkyl group, alkenyl group or alkynyl group, R2 The, H, halogen (F, Cl, Br or I), or a C1 - 4 The alkyl group, the ring A, 5 - 8 membered lactam ring showing; however, R1 And R2 Except H together. )[Drawing] no (by machine translation)

ANTIBACTERIAL COMPOUNDS

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Page/Page column 83-84, (2019/05/22)

The present invention relates to compounds of general formula (II),to compositions comprising these compounds and to methods of treating Enterobacteriaceae bacterial diseases and infections using the compounds. The compounds find application in the treatment of infection with, and diseases caused by, Enterobacteriaceae.

NOVEL GPR119 AGONIST COMPOUNDS

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, (2017/10/26)

The present invention relates to novel compounds of formula (I), process for preparation of the same and composition comprising these compounds.

18F LABELLED THIAZOLYLHYDRAZONE DERIVATIVES

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, (2016/07/05)

The present invention relates to compounds of Formula (I) wherein R1 and R2 are independently selected from 19F and 18F having selective binding for MAO-B as compared with MAO-A. The invention also provides radi

Design, Synthesis, and Structure-Activity Relationships of Pyridine-Based Rho Kinase (ROCK) Inhibitors

Green, Jeremy,Cao, Jingrong,Bandarage, Upul K.,Gao, Huai,Court, John,Marhefka, Craig,Jacobs, Marc,Taslimi, Paul,Newsome, David,Nakayama, Tomoko,Shah, Sundeep,Rodems, Steve

, p. 5028 - 5037 (2015/07/02)

The Rho kinases (ROCK1 and ROCK2) are highly homologous serine/threonine kinases that act on substrates associated with cellular motility, morphology, and contraction and are of therapeutic interest in diseases associated with cellular migration and contraction, such as hypertension, glaucoma, and erectile dysfunction. Beginning with compound 4, an inhibitor of ROCK1 identified through high-throughput screening, systematic exploration of SAR, and application of structure-based design, led to potent and selective ROCK inhibitors. Compound 37 represents significant improvements in inhibition potency, kinase selectivity, and CYP inhibition and possesses pharmacokinetics suitable for in vivo experimentation.

PTERIDINES AND THEIR USE AS AGROCHEMICALS

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, (2011/04/14)

The present disclosure relates to 1- or 2-(4-(aryloxy)-phenyl)ethylamino-, oxy- or sulfanyl)pteridines and 1- or 2-(4-(heteroaryloxy)-phenyl)ethylamino-, oxy- or sulfanyl)pteridines and their use as agrochemicals and animal health products.

PTERIDINES AND THEIR USE AS AGROCHEMICALS

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, (2011/04/14)

The present disclosure relates to 1- or 2-(4-(aryloxy)-phenyl)ethylamino-, oxy- or sulfanyl)pteridines and 1- or 2-(4-(heteroaryloxy)-phenyl)ethylamino-, oxy- or sulfanyl)pteridines and their use as agrochemicals and animal health products.

5,8-DIFLUORO-4-(2-(4-(HETEROARYLOXY)-PHENYL)ETHYLAMINO)QUINAZOLINES AND THEIR USE AS AGROCHEMICALS

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Page/Page column 50-51, (2010/04/06)

The present disclosure relates to 5,8-difluoro-4-(2-(4-(heteroaryloxy)-phenyl)ethylamino)quinazolines and their use as agrochemicals and animal health products.

4-Pyridylanilinothiazoles that selectively target von Hippel - Lindau deficient renal cell carcinoma cells by inducing autophagic cell death

Hay, Michael P.,Turcotte, Sandra,Flanagan, Jack U.,Bonnet, Muriel,Chan, Denise A.,Sutphin, Patrick D.,Nguyen, Phuong,Giaccia, Amato J.,Denny, William A.

supporting information; experimental part, p. 787 - 797 (2010/07/05)

Renal cell carcinomas (RCC) are refractory to standard therapy with advanced RCC having a poor prognosis; consequently treatment of advanced RCC represents an unmet clinical need. The von Hippel-Lindau (VHL) tumor suppressor gene is mutated or inactivated in a majority of RCCs. We recently identified a 4-pyridyl-2-anilinothiazole (PAT) with selective cytotoxicity against VHL-deficient renal cells mediated by induction of autophagy and increased acidification of autolysosomes. We report exploration of structure-activity relationships (SAR) around this PAT lead. Analogues with substituents on each of the three rings, and various linkers between rings, were synthesized and tested in vitro using paired RCC4 cell lines. A contour map describing the relative spatial contributions of different chemical features to potency illustrates a region, adjacent to the pyridyl ring, with potential for further development. Examples probing this domain validated this approach and may provide the opportunity to develop this novel chemotype as a targeted approach to the treatment of RCC. 2009 American Chemical Society.

HETEROARYL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE IN CANCER TREATMENT

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, (2009/10/22)

Provided herein are novel heteroaryl compounds, compositions comprising the compounds, and methods of treatment or prevention comprising administration of the compounds. The compounds are effective in the targeting of cells defective in the von Hippel-Lindau gene and in inducing autophagic cell death. The methods are directed to treating or preventing diseases such as cancer, and in particular cancers resulting from von Hippel-Lindau disease. The compounds of the invention may be administered in combination with another therapeutic agent.

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