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METHYL 1-BENZYL-5-OXO-3-PYRROLIDINECARBOXYLATE is a white to slightly yellowish powder that has been successfully separated into its enantiomers using methylchlorophenyl carbamate of cellulose and of amylose as polysaccharide chiral stationary phases by high-performance liquid chromatography (HPLC). METHYL 1-BENZYL-5-OXO-3-PYRROLIDINECARBOXYLATE is of interest due to its potential applications in various industries.

51535-00-3

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51535-00-3 Usage

Uses

Used in Pharmaceutical Industry:
METHYL 1-BENZYL-5-OXO-3-PYRROLIDINECARBOXYLATE is used as an intermediate in the synthesis of various pharmaceutical compounds. Its enantiomeric separation allows for the development of more effective and targeted drugs, as different enantiomers can have distinct biological activities.
Used in Chemical Synthesis:
METHYL 1-BENZYL-5-OXO-3-PYRROLIDINECARBOXYLATE is used as a building block in the synthesis of complex organic molecules. Its unique structure and functional groups make it a valuable component in the creation of new compounds with potential applications in various fields.
Used in Research and Development:
METHYL 1-BENZYL-5-OXO-3-PYRROLIDINECARBOXYLATE is used as a research compound for studying its properties, reactivity, and potential applications in different industries. This can lead to the discovery of new uses and the development of innovative products.
Used in Analytical Chemistry:
METHYL 1-BENZYL-5-OXO-3-PYRROLIDINECARBOXYLATE can be used as a reference material or standard in analytical chemistry for the development and validation of new methods and techniques for enantiomeric separation and analysis.

Check Digit Verification of cas no

The CAS Registry Mumber 51535-00-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,1,5,3 and 5 respectively; the second part has 2 digits, 0 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 51535-00:
(7*5)+(6*1)+(5*5)+(4*3)+(3*5)+(2*0)+(1*0)=93
93 % 10 = 3
So 51535-00-3 is a valid CAS Registry Number.
InChI:InChI=1S/C13H15NO3/c1-17-13(16)11-7-12(15)14(9-11)8-10-5-3-2-4-6-10/h2-6,11H,7-9H2,1H3

51535-00-3 Well-known Company Product Price

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  • Aldrich

  • (183679)  Methyl1-benzyl-5-oxo-3-pyrrolidinecarboxylate  97%

  • 51535-00-3

  • 183679-5G

  • 366.21CNY

  • Detail
  • Aldrich

  • (183679)  Methyl1-benzyl-5-oxo-3-pyrrolidinecarboxylate  97%

  • 51535-00-3

  • 183679-25G

  • 1,057.68CNY

  • Detail

51535-00-3SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name Methyl 1-Benzyl-5-Oxo-3-Pyrrolidinecarboxylate

1.2 Other means of identification

Product number -
Other names METHYL 1-BENZYL-5-OXO-3-PYRROLIDINECARBOXYLATE

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:51535-00-3 SDS

51535-00-3Relevant academic research and scientific papers

Condensed 2-pyrrolidinone-1,2-oxazines from lithium enolate of 1-benzyl-5-oxo-3-pyrrolidinecarboxylic acid and β-aryl, β-nitroenamines

Felluga, Fulvia,Gombac, Valentina,Pitacco, Giuliana,Valentin, Ennio,Zangrando, Ennio,Morganti, Stefano,Rizzato, Egon,Spinelli, Domenico,Petrillo, Giovanni

, p. 8787 - 8791 (2006)

The reaction of the lithium enolate of 1-benzyl-5-oxo-3-pyrrolidinecarboxylic acid 3 with a series of β-aryl, β-nitroenamines unexpectedly afforded 6-aryl-2-benzyl-4-oxa-1-oxo-3a-methoxycarbonyl-2,5-diazaindenes 9a-d, whose structure was determined by analytical and NMR spectroscopical analysis. The structure of 9b was further confirmed by X-ray analysis. A reasonable mechanism for their formation is given.

Borinic Acid Catalysed Reduction of Tertiary Amides with Hydrosilanes: A Mild and Chemoselective Synthesis of Amines

Chardon, Aurélien,Mohy El Dine, Tharwat,Legay, Rémi,De Paolis, Micha?l,Rouden, Jacques,Blanchet, Jér?me

supporting information, p. 2005 - 2009 (2017/02/19)

A reduction of various aryl, alkyl, and α,β-unsaturated amides with phenylsilane, catalysed by a borinic acid, is reported. The unprecedented reaction was carried out under very mild conditions and led to useful amines. Furthermore, the reaction tolerates a variety of functional groups. Initial investigations implicated that an intermediate diarylhydroborane is involved in the reaction mechanism.

A method for preparing west Naira Tanzania

-

Paragraph 0030; 0031; 0032; 0033, (2017/08/25)

The invention discloses a preparation method for nebracetam, and belongs to the technical field of medical chemistry. The key points of the technical scheme of the invention are as follows: the preparation method for the nebracetam comprises the following steps: performing Michael addition reaction and intramolecular cyclization on dimethyl itaconate and benzylamine serving as raw materials to obtain 1-benzyl-5-oxopyrrolidin-3-carboxylic methyl ester; reducing the 1-benzyl-5-oxopyrrolidin-3-carboxylic methyl ester by sodium borohydride to obtain 1-benzyl-4-hydroxymethyl-pyrrolidine-2-keton; performing methyl sulfonylation on the 1-benzyl-4-hydroxymethyl-pyrrolidine-2-keton to obtain 1-benzyl-5-oxopyrrolidin-3-carboxylic methanesulfonate; finally, performing ammonification and reduction on the 1-benzyl-5-oxopyrrolidin-3-carboxylic methanesulfonate by using ammonia water to obtain the nebracetam. The preparation method is simple in preparation process, easy to control and high in target product yield, and meets the requirement for green chemistry.

Reductive Alkylation of Tertiary Lactams via Addition of Organocopper (RCu) Reagents to Thioiminium Ions

Mateo, Pierre,Cinqualbre, Joséphine E.,Meyer Mojzes, Melinda,Schenk, Kurt,Renaud, Philippe

supporting information, p. 12318 - 12327 (2017/12/08)

A simple procedure for the conversion of tertiary lactams to 2-monoalkylated cyclic amines is described. The reaction sequence involves conversion of a lactam to a thioiminium ion followed by reaction with an organocopper (RCu) reagent and final reduction with triacetoxyborohydride. The reaction is high yielding and shows an excellent functional group tolerance. Its utility is demonstrated by a rapid synthesis of indolizidine 167B. The excellent chemoselectivity of the process, where only monoalkylation products are formed, is rationalized by a mechanism involving the formation of a transient enamine.

Inhibition of noroviruses by piperazine derivatives

Dou, Dengfeng,He, Guijia,Mandadapu, Sivakoteswara Rao,Aravapalli, Sridhar,Kim, Yunjeong,Chang, Kyeong-Ok,Groutas, William C.

supporting information; experimental part, p. 377 - 379 (2012/02/16)

There is currently an unmet need for the development of small-molecule therapeutics for norovirus infection. The piperazine scaffold, a privileged structure embodied in many pharmacological agents, was used to synthesize an array of structurally-diverse derivatives which were screened for anti-norovius activity in a cell-based replicon system. The studies described herein demonstrate for the first time that functionalized piperazine derivatives possess anti-norovirus activity. Furthermore, these studies have led to the identification of two promising compounds (6a and 9l) that can be used as a launching pad for the optimization of potency, cytotoxicity, and drug-like characteristics.

Concise synthesis of bicyclic aminals by way of catalytic intramolecular C-H amination and evaluation of their reactivity as iminium precursors

Rodriguez-Lucena, David,Morin, Marie S.T.,Compain, Philippe

scheme or table, p. 155 - 162 (2012/04/04)

The concise synthesis of fused bicyclic aminals by way of intramolecular rhodium-catalyzed C-H amination is reported as well as the evaluation of their reactivity as iminium precursors. In contrast to the well-studied N,O-acetal systems, the aminals synthesized were found to be particularly stable under reaction conditions used for nucleophilic addition.

Synthesis of new β-trifluoromethyl containing GABA and β-fluoromethyl containing N-benzylpyrrolidinones

Gerus, Igor I.,Mironets, Roman V.,Shaitanova, Elena N.,Kukhar, Valery P.

experimental part, p. 224 - 228 (2010/04/30)

A whole series of 3-(mono-, di-, trifluoro)methyl-substituted N-benzylpyrrolidinones 5a-c was synthesized by deoxyfluorination of corresponding 3-functionalized N-benzylpyrrolidinones. New β-trifluoromethyl containing GABA 4a was obtained in two alternative ways: by successive hydrolysis and hydrogenolysis of 3-trifluoromethyl N-benzylpyrrolidinone 5a and from trifluoroacetone as starting compound.

Intramolecular 1,6-addition to 2-pyridones. Mechanism and synthetic scope

Gallagher, Timothy,Derrick, Ian,Durkin, Patrick M.,Haseler, Claire A.,Hirschhaeuser, Christoph,Magrone, Pietro

supporting information; experimental part, p. 3766 - 3774 (2010/08/20)

Figure presented The scope and limitations of the intramolecular 1,6-addition of an enolate to a 2-pyridone moiety, a reaction that has found application in the synthesis of the lupin alkaloids, have been probed. This nucleophilic addition process has been shown to be reversible and favored in the case of (less stabilized) amide and lactam enolates, which readily form five- and six-membered bi-/tricyclic products. Alternative enolates (ketone, ester, thiolactam) and a variety of different acceptors (isoquinolinone, pyrimidinone, pyrazinone, pyridopyrazinone) have been evaluated, and a range of competing side reactions have been identified and characterized using various techniques, including in situ IR.

Discovery of an orally efficaceous 4-phenoxypyrrolidine-based BACE-1 inhibitor

Iserloh,Pan,Stamford,Kennedy,Zhang,Zhang,Parker,McHugh,Favreau,Strickland,Voigt

, p. 418 - 422 (2008/09/18)

Based on a lead compound identified from the patent literature, we developed patentably novel BACE-1 inhibitors by introducing a cyclic amine scaffold as embodied by 1a and 1b. Extensive SAR studies assessed a variety of isophthalamide replacements including substituted pyrrolidinones and ultimately led to the identification of 11. Due to its favorable overall profile, 11 has been extensively profiled in various in vivo settings.

Synthesis of functionalized nitrogen heterocycles by radical decarboxylation of β- and γ-amino acids

Boto, Alicia,Hernandez, Rosendo,De Leon, Yolanda,Murguia, Jose R.,Rodriguez-Afonso, Abigail

, p. 673 - 682 (2007/10/03)

Iodinated or oxygenated nitrogen heterocycles are obtained by radical decarboxylation of β- and γ-amino acids. This mild, versatile reaction is applied to the synthesis of bioactive products, such as 4-arylpiperidines, hydroxylated piperidines, and new antifungal agents.

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