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1-tert-butyl 2-methyl 2-methylpyrrolidine-1,2-dicarboxylate is a pyrrolidine-based chemical compound with the molecular formula C13H21NO4. It features a tert-butyl group and a methyl group attached to the pyrrolidine ring, along with two carboxylate groups. This unique structure and properties make it a valuable compound in organic synthesis and pharmaceutical research, with potential applications in the development of new drugs and pharmaceuticals. Its biological activities are yet to be fully explored for medicinal purposes, necessitating further research.

317355-80-9

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317355-80-9 Usage

Uses

Used in Pharmaceutical Research:
1-tert-butyl 2-methyl 2-methylpyrrolidine-1,2-dicarboxylate is used as a key intermediate in the synthesis of various pharmaceutical compounds. Its unique structure allows for the development of new drugs with potential therapeutic benefits.
Used in Organic Synthesis:
In the field of organic synthesis, 1-tert-butyl 2-methyl 2-methylpyrrolidine-1,2-dicarboxylate serves as a versatile building block for the creation of complex organic molecules. Its functional groups can be further modified to produce a wide range of chemical products.
Used in Drug Development:
Due to its potential biological activities, 1-tert-butyl 2-methyl 2-methylpyrrolidine-1,2-dicarboxylate is used as a starting material in drug development. Its unique structure may contribute to the discovery of new therapeutic agents with novel mechanisms of action.
Used in Medicinal Chemistry:
In medicinal chemistry, 1-tert-butyl 2-methyl 2-methylpyrrolidine-1,2-dicarboxylate is utilized for the design and optimization of drug candidates. Its structural features can be exploited to enhance the potency, selectivity, and pharmacokinetic properties of new pharmaceuticals.

Check Digit Verification of cas no

The CAS Registry Mumber 317355-80-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 3,1,7,3,5 and 5 respectively; the second part has 2 digits, 8 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 317355-80:
(8*3)+(7*1)+(6*7)+(5*3)+(4*5)+(3*5)+(2*8)+(1*0)=139
139 % 10 = 9
So 317355-80-9 is a valid CAS Registry Number.

317355-80-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-O-tert-butyl 2-O-methyl 2-methylpyrrolidine-1,2-dicarboxylate

1.2 Other means of identification

Product number -
Other names 2-methyl-pyrrolidine-1,2-dicarboxylic acid 1-tert-butyl ester 2-methyl 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:317355-80-9 SDS

317355-80-9Relevant academic research and scientific papers

Interrupted Curtius Rearrangements of Quaternary Proline Derivatives: A Flow Route to Acyclic Ketones and Unsaturated Pyrrolidines

Baumann, Marcus,Moody, Thomas S.,Smyth, Megan,Wharry, Scott

, p. 14199 - 14206 (2021/07/20)

Conversion of N-Boc-protected quaternary proline derivatives under thermal Curtius rearrangement conditions was found to afford a series of ring-opened ketone and unsaturated pyrrolidine products instead of the expected carbamate species. The nature of the substituent on the quaternary carbon thereby governs the product outcome due to the stability of a postulated N-acyliminium species. A continuous flow process with in-line scavenging was furthermore developed to streamline this transformation and safely create products on a gram scale.

Design and Synthesis of 56 Shape-Diverse 3D Fragments

Atobe, Masakazu,Blakemore, David C.,Bond, Paul S.,Chan, Ngai S.,De Fusco, Claudia,Downes, Thomas D.,Firth, James D.,Hubbard, Roderick E.,Jones, S. Paul,Klein, Hanna F.,O'Brien, Peter,Roughley, Stephen D.,Vidler, Lewis R.,Waddelove, Laura,Whatton, Maria Ann,Wheldon, Mary C.,Woolford, Alison J.-A.,Wrigley, Gail L.

supporting information, (2020/07/13)

Fragment-based drug discovery is now widely adopted for lead generation in the pharmaceutical industry. However, fragment screening collections are often predominantly populated with flat, 2D molecules. Herein, we describe a workflow for the design and synthesis of 56 3D disubstituted pyrrolidine and piperidine fragments that occupy under-represented areas of fragment space (as demonstrated by a principal moments of inertia (PMI) analysis). A key, and unique, underpinning design feature of this fragment collection is that assessment of fragment shape and conformational diversity (by considering conformations up to 1.5 kcal mol?1 above the energy of the global minimum energy conformer) is carried out prior to synthesis and is also used to select targets for synthesis. The 3D fragments were designed to contain suitable synthetic handles for future fragment elaboration. Finally, by comparing our 3D fragments with six commercial libraries, it is clear that our collection has high three-dimensionality and shape diversity.

2-PYRROLIDINE PHENYLHYDRAZIDES ANTIBACTERIAL AGENTS

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Page/Page column 58, (2018/02/28)

2-Pyrrolidine phenylhydrazides antibacterial agents The present invention relates to 2-pyrrolidine phenylhydrazide compounds of formula (I), which are selective antibacterials specifically agalnstAcineto barter baumannii.The invention also relates to their therapeutic use as antibacterials, to a process for their preparation and to pharmaceutical compositions containing them.

COMPOUNDS FOR TREATING DISORDERS MEDIATED BY METABOTROPIC GLUTAMATE RECEPTOR 5, AND METHODS OF USE THEREOF

-

Page/Page column 177, (2011/07/07)

Provided herein are compounds and methods of synthesis thereof. The compounds set forth herein are useful for the treatment, prevention, and/or management of various disorders, such as neurological disorders, neurodegenerative disorders, neuropsychiatric disorders, disorders of cognition, learning or memory, gastrointestinal disorders, lower urinary tract disorder, and cancer. Compounds set forth herein modulate the activity of metabotropic glutamate receptor 5 (mGluR5) in the central nervous system or the periphery. Pharmaceutical formulations containing the compounds and their methods of use are also provided herein.

Structure-reactivity relationships of l-proline derived spirolactams and α-methyl prolinamide organocatalysts in the asymmetric Michael addition reaction of aldehydes to nitroolefins

Kelleher, Fintan,Kelly, Sinead,Watts, John,McKee, Vickie

experimental part, p. 3525 - 3536 (2010/06/17)

l-Proline derived spirolactams and α-methyl prolinamides act as organocatalysts for the asymmetric conjugate addition of aldehydes to nitroolefins in excellent yields, with good diastereoselectivity and enantioselectivity. Furthermore, low catalyst loadings (5 mol %) and a low aldehyde molar excess (1.5 M equiv) were achieved.

Intramolecular conjugate displacement: A general route to hexahydroquinolizines, hexahydroindolizines, and related [m,n,0]-bicyclic structures with nitrogen at a bridgehead

Clive, Derrick L. J.,Li, Zhiyong,Yu, Maolin

, p. 5608 - 5617 (2008/02/09)

(Chemical Equation Presented) N-Protected amino aldehydes can be converted into allylic alcohols by the classical Morita-Baylis-Hillman reaction (cf. 2 → 3) or by condensation with selenium-stabilized carbanions, followed by oxidation (cf. 2 → 8 → 3). The

Novel antibacterial class: A series of tetracyclic derivatives

Hinman, Mira M.,Rosenberg, Teresa A.,Balli, Darlene,Black-Schaefer, Candace,Chovan, Linda E.,Kalvin, Douglas,Merta, Philip J.,Nilius, Angela M.,Pratt, Steve D.,Soni, Niru B.,Wagenaar, Frank L.,Weitzberg, Moshe,Wagner, Rolf,Beutel, Bruce A.

, p. 4842 - 4856 (2007/10/03)

We describe the synthesis and antibacterial activity of a series of tetracyclic naphthyridones. The members of this series act primarily via inhibition of bacterial translation and belong to the class of novel ribosome inhibitors (NRIs). In this paper we

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