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2051-97-0

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2051-97-0 Usage

Description

1-Benzylpyrrole, synthesized from N-benzylpyrrolidine through oxidation with 2-iodoxybenzoic acid (IBX) in the presence of β-cyclodextrin in an aqueous medium, is a white transparent liquid. It serves as a crucial intermediate in the synthesis of various organic compounds, particularly in the pharmaceutical and chemical industries.

Uses

1-Benzylpyrrole is used as a synthetic intermediate for the creation of various organic compounds, including:
Used in Pharmaceutical Industry:
1-Benzylpyrrole is used as a key component in the synthesis of several pharmaceutical compounds, such as:
(E,Z)-3-(7,8-dimethoxy-5H-pyrrolo[2,1-a]isoindol-3-yl)-N,N-diethylacrylamide
(E,Z)-7,8-dimethoxy-3-styryl-5H-pyrrolo[2,1-a]isoindole
Pyrroloisoquinolines
(Z)-2-(7,8-dimethoxypyrrolo[1,2-b]isoquinolin-10-ylidene)-N,N-diethylacetamide
(E,Z)-10-benzylidene-7,8-dimethoxy-5,10-dihydropyrrolo-[1,2-b]isoquinoline
(E,Z)-7,8-dimethoxy-10-(2-methoxyvinyl)-5,10-dihydropyrrolo[1,2-b]isoquinoline
(Z)-7,8-dimethoxy-10-(methoxymethylene)-5,10-dihydropyrrolo[1,2-b]isoquinoline
2-cyano-N-benzylpyrroles
3-cyano-N-benzylpyrroles
These compounds have potential applications in the development of new drugs and therapeutic agents, contributing to the advancement of medical treatments and healthcare solutions.
Used in Chemical Industry:
1-Benzylpyrrole is also utilized as a versatile building block in the chemical industry for the synthesis of various complex organic molecules, which can be employed in a wide range of applications, such as dyes, pigments, and advanced materials. Its unique chemical properties make it a valuable asset in the development of novel chemical products and technologies.

Synthesis Reference(s)

Journal of Heterocyclic Chemistry, 31, p. 1715, 1994 DOI: 10.1002/jhet.5570310674Synthetic Communications, 25, p. 1857, 1995 DOI: 10.1080/00397919508015431Synthesis, p. 457, 1996 DOI: 10.1055/s-1996-4247

Check Digit Verification of cas no

The CAS Registry Mumber 2051-97-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 2,0,5 and 1 respectively; the second part has 2 digits, 9 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 2051-97:
(6*2)+(5*0)+(4*5)+(3*1)+(2*9)+(1*7)=60
60 % 10 = 0
So 2051-97-0 is a valid CAS Registry Number.
InChI:InChI=1/C11H11N/c1-2-6-11(7-3-1)10-12-8-4-5-9-12/h1-9H,10H2

2051-97-0 Well-known Company Product Price

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  • TCI America

  • (B2335)  1-Benzylpyrrole  >98.0%(GC)

  • 2051-97-0

  • 5g

  • 650.00CNY

  • Detail
  • Alfa Aesar

  • (H55936)  1-Benzylpyrrole, 97%   

  • 2051-97-0

  • 1g

  • 188.0CNY

  • Detail
  • Alfa Aesar

  • (H55936)  1-Benzylpyrrole, 97%   

  • 2051-97-0

  • 5g

  • 657.0CNY

  • Detail
  • Alfa Aesar

  • (H55936)  1-Benzylpyrrole, 97%   

  • 2051-97-0

  • 25g

  • 2449.0CNY

  • Detail
  • Aldrich

  • (566322)  N-Benzylpyrrole  97%

  • 2051-97-0

  • 566322-5G

  • 1,027.26CNY

  • Detail

2051-97-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-BENZYLPYRROLE

1.2 Other means of identification

Product number -
Other names 1-Benzyl-1H-pyrrole

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:2051-97-0 SDS

2051-97-0Relevant articles and documents

Synthesis of a poly(ethylene glycol)-supported tetrakis ammonium salt: A recyclable phase-transfer catalyst of improved catalytic efficiency

Benaglia, Maurizio,Cinquini, Mauro,Cozzi, Franco,Tocco, Graziella

, p. 3391 - 3393 (2002)

The immobilization of four quaternary ammonium groups on a poly(ethylene glycol) support provided an efficient and recyclable phase-transfer catalyst.

Pyrrole synthesis using a tandem Grubbs' carbene-RuCl3 catalytic system

Dieltiens, Nicolai,Stevens, Christian V.,Vos, David De,Allaert, Bart,Drozdzak, Renata,Verpoort, Francis

, p. 8995 - 8998 (2004)

A straightforward pyrrole synthesis from diallylamines is developed by using a tandem catalyst system leading to ring-closing metathesis with the second generation Grubbs' catalyst (10%) followed by dehydrogenation in the presence of RuCl3 × H2O (2%).

A new method to N-arylmethylenepyrroles from N-acylpyrroles

D'Silva, Claudius,Iqbal, Rifat

, p. 457 - 458 (1996)

An efficient general method for the preparation of N-arylmethylenepyrroles based on the reduction of N-acylpyrroles is reported. The reduction procedure described is sufficiently mild to make it applicable to a variety of sensitive acyl and heterocyclic acyl compounds where reduction results in cleavage of the C-N bond. The method can also be used in the preparation of pyrrole derivatives containing base sensitive protecting groups.

Development of Pd(OAc)2-catalyzed tandem oxidation of C[sbnd]N, C[sbnd]C, and C(sp3)–H bonds: Concise synthesis of 1-aroylisoquinoline, oxoaporphine, and 8-oxyprotoberberine alkaloids

Nishimoto, Saeko,Nakahashi, Hiromichi,Toyota, Masahiro

, (2020/11/13)

A catalytic tandem oxidation of C[sbnd]N, C[sbnd]C, and C(sp3)–H bonds is developed. This tandem oxidation is applied to two-step total syntheses of papaveraldine and pulcheotine A. Additionally, the total synthesis of liriodenine is achieved in six steps from homopiperonyl alcohol and 2-bromophenylacetonitrile by applying this catalytic tandem oxidation. Moreover, the direct conversion of xylopinine to 8-oxypseudopalmatine in a 76% yield demonstrates the versatility of this catalytic reaction.

Lactam derivatives and preparation method and application thereof

-

Paragraph 0066-0070, (2020/02/10)

The invention relates to lactam derivatives and a preparation method and application thereof. Compared with the prior art, the invention provides lactam compounds with a novel structure. The compoundsand compositions thereof have remarkable activity in inhibition of the proliferation of cancer cells (including, but not limited to, the liver cancer cell line HepG2 and the lung cancer cell line A549), and the activity of multiple compounds is in the same order of magnitude as the activity of the commercial drug adriamycin or superior to the activity of adriamycin. The compounds of the inventioncan be prepared from N-substituted pyrrole compounds through a reaction, and the preparation method is convenient, rapid and efficient.

Multifunctional 2- and 3-Fluoropyrroles

Heeran, Darren,Sandford, Graham

supporting information, p. 2339 - 2343 (2019/02/27)

Sequential reaction cascades for the synthesis of polysubstituted 2- and 3-fluoropyrrole derivatives from common polybromopyrrole precursors have been developed. A strategic variation of a combination of regioselective debromolithiation followed by trapping of the corresponding carbanions by electrophilic fluorination and Pd catalysed cross-coupling reactions allows access to polyfunctional fluoropyrrole products by methodology applicable to drug discovery programs, extending the range of five-membered fluoroazaheteroaromatic derivatives potentially available for incorporation into screening libraries.

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