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Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate is a pyridine derivative with the molecular formula C12H13NO3. It belongs to the class of organic compounds known as pyridinecarboxylic acids and derivatives. This chemical compound is often used as an intermediate in the synthesis of various pharmaceuticals and agrochemicals. It may also have potential applications in the field of organic chemistry as a building block for the preparation of other complex molecules. However, proper handling and safety precautions should be followed when working with ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate.

21683-58-9

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21683-58-9 Usage

Uses

Used in Pharmaceutical Industry:
Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate is used as an intermediate in the synthesis of various pharmaceuticals. Its unique structure allows it to be a key component in the development of new drugs and medications.
Used in Agrochemical Industry:
Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate is also used as an intermediate in the synthesis of agrochemicals. Its properties make it suitable for the development of new pesticides and other agricultural chemicals.
Used in Organic Chemistry:
Ethyl 3-(2-methyl-5-pyridyl)-3-oxopropionate is used as a building block in the preparation of other complex molecules in the field of organic chemistry. Its versatility and unique structure make it a valuable component in the synthesis of various organic compounds.

Check Digit Verification of cas no

The CAS Registry Mumber 21683-58-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,1,6,8 and 3 respectively; the second part has 2 digits, 5 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 21683-58:
(7*2)+(6*1)+(5*6)+(4*8)+(3*3)+(2*5)+(1*8)=109
109 % 10 = 9
So 21683-58-9 is a valid CAS Registry Number.
InChI:InChI=1/C11H13NO3/c1-3-15-11(14)6-10(13)9-5-4-8(2)12-7-9/h4-5,7H,3,6H2,1-2H3

21683-58-9SDS

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 ethyl 3-(6-methylpyridin-3-yl)-3-oxopropanoate

1.2 Other means of identification

Product number -
Other names 6-methyl nicotinoyl acetic acid ethyl ester

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:21683-58-9 SDS

21683-58-9Relevant academic research and scientific papers

PHARMACEUTICAL COMPOUNDS

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Page/Page column 61; 62, (2021/02/26)

Benzodiazepine derivatives of formula (I): (I) wherein: each of R1 and R2 is independently H or halo; either (i) T is N, Z is C, ---a--- and ---c--- are bonds, and ---b--- and ---d--- are absent; or (ii) T is C, Z is N, ---b--- and ---d--- are bonds, and ---a--- and ---c--- are absent; each of R3 and R4 is independently halo, -OR6, -NR6R7, -COR8, -C(O)OR8, -CON(R8)2 or -R6; R5 is H or halo; each of R6 and R7 is independently H or a group selected from C1-C6 alkyl, C3-C10 cycloalkyl, C6-C10 aryl, 4- to 10-membered heterocyclyl and 4- to 10-membered heteroaryl, the group being unsubstituted or substituted; R8 is H or C1-C6 alkyl, each R8 being the same or different when two are present; n is 0 or 1; and one of V, W, X and Y is N or CH and the other three are CH; and the pharmaceutically acceptable salts thereof are inhibitors of RSV and can therefore be used to treat or prevent an RSV infection.

NAPHTHYRIDINE AND PYRIDO[3,4-c]PYRIDAZINE DERIVATIVES AS GABAA α5 RECEPTOR MODULATORS

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Page/Page column 51, (2021/10/02)

The present invention provides compounds of formula (I) and/or salts thereof and/or biologically active metabolites thereof and/or prodrugs thereof and/or solvates thereof and/or hydrates thereof and/or polymorphs thereof having affinity and selectivity for the gamma-aminobutyric acid A receptor subunit alpha 5 and act as GABAA α5 positive allosteric modulators, thereby useful in the treatment or prevention of diseases related to the GABAA α5 receptor, process for the preparation and intermediates of the preparation process thereof, pharmaceutical compositions comprising them alone or in combination with one or more other active ingredients and their use as medicaments.

Efficient one-pot selective reduction of esters in β-ketoesters using LiHMDS and lithium aluminium hydride

Sivagurunathan,Raja Mohamed Kamil,Syed Shafi,Liakth Ali Khan,Ragavan, R. Venkat

experimental part, p. 1205 - 1207 (2011/03/21)

The ester functionality in β-keto esters is selectively reduced in one-pot, first by enolization using LiHMDS and then reduced with lithium aluminium hydride. This method produces β-hydroxyl ketones from the corresponding β-keto esters in high yield.

METHODS AND COMPOSITIONS RELATED TO WRAPPING OF DEHYDRONS

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Page/Page column 40-41, (2008/12/06)

This application describes a novel technology in drug discovery and drug-based imaging/detection: the wrapping technology. This technology is based on identified singularities in the structure of soluble proteins. In contrast with drug-design approaches based on standard structural considerations, the packing of a protein, or more precisely, its dehydron pattern, may be used as a selectivity filter to design small-molecule inhibitors. The wrapping technology described herein is a novel form of rational drug design for avoiding side effects in drug therapy and sharpening the inhibitory impact of drugs on the oncokinome.

Synthesis and biological activity of metabolites of the antidiabetic, antihyperglycemic agent pioglitazone

Tanis, Steven P.,Parker, Timothy T.,Colca, Jerry R.,Fisher, Roberta M.,Kletzein, Rolf F.

, p. 5053 - 5063 (2007/10/03)

Pioglitazone (5-(4-(2-(5-ethyl-2-pyridyl)ethoxy)benzyl)-2,4- thiazolidinedione, 2) is a prototypical antidiabetic thiazolidinedione that had been evaluated for possible clinical development. Metabolites 6-9 have been identified after dosing of rats and dogs. Ketone 10 has not yet been identified as a metabolite but has been added to the list as a putative metabolite by analogy to alcohol 6 and ketone 7. We have developed improved syntheses of pioglitazone (2) metabolites 6-9 and the putative metabolite ketone 10. These entities have been compared in the KKA(y) mouse model of human type-II diabetes to pioglitazone (2). Ketone 10 has proven to be the most potent of these thiazolidinediones in this in vivo assay. When 6-10 were compared in vitro in the 3T3-L1 cell line to 2, for their ability to augment insulin-stimulated lipogenesis, 10 was again the most potent compound with 6, 7, and 9 roughly equivalent to 2. These data suggest that metabolites 6, 7, and 9 are likely to contribute to the pharmacological activity of pioglitazone (2), as had been previously reported for ciglitazone (1).

3-hydroxy-3-(2-methyl-5-pyridyl)-propionic acid alkyl esters

-

, (2008/06/13)

3-Hydroxy-3-(2-methyl-5-pyridyl)-propionic acid alkyl esters which, as intermediate products that can be industrially produced in a simple manner, can be used for the production of 2-methylpyridine-5-propionic acid alkyl ester.

3-(Pyridinyl)-2-cyclohexen-1-ones

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, (2008/06/13)

3-(4 OR 3-Pyridinyl)-2-cyclohexen-1-ones (I) and their oxime derivatives are useful in preparing (3-aminophenyl)-pyridines, in turn, useful in preparing known antibacterial agents. Also shown is the preparation of I by starting with the reaction of methyl vinyl ketone with either 1-(pyridinyl)-1-(lower-tertiary-amino)-ethylene (II) or lower-alkyl 3-(pyridinyl)-3-oxopropanoate. Also shown is the process of converting I to its oxime, acylating the oxime and heating the acylated oxime under acidic conditions to produce N-(lower-acyl)-3-(pyridinyl)-aniline (VII), and hydrolyzing VII under aqueous alkaline conditions to produce the corresponding 3-(pyridinyl)aniline.

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