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3-Bromo-5-(prop-1-en-2-yl)pyridine is an organic compound with the molecular formula C8H8BrN. It is a brominated derivative of pyridine, characterized by the presence of a bromine atom and a prop-1-en-2-yl group on the five-carbon position of the pyridine ring. This chemical is commonly used in organic synthesis and medicinal chemistry as a building block for the preparation of various pharmaceuticals and agrochemicals. It is also utilized as a reagent in the synthesis of heterocyclic compounds. 3-Bromo-5-(prop-1-en-2-yl)pyridine is a colorless to light yellow liquid, with a strong, pungent odor, and it should be handled with care due to its potential hazards, such as being flammable and toxic if ingested or absorbed through the skin.

40472-88-6

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40472-88-6 Usage

Uses

Used in Organic Synthesis:
3-Bromo-5-(prop-1-en-2-yl)pyridine is used as a building block in organic synthesis for the preparation of various pharmaceuticals and agrochemicals. Its unique structure allows for further functionalization and modification, making it a versatile intermediate in the synthesis of complex organic molecules.
Used in Medicinal Chemistry:
In the field of medicinal chemistry, 3-Bromo-5-(prop-1-en-2-yl)pyridine is used as a key intermediate for the development of new drugs. Its presence in the molecular structure can impart specific biological activities, such as anti-inflammatory, antimicrobial, or anticancer properties, depending on the final compound synthesized.
Used in Synthesis of Heterocyclic Compounds:
3-Bromo-5-(prop-1-en-2-yl)pyridine is also utilized as a reagent in the synthesis of heterocyclic compounds. Its ability to form various heterocyclic rings makes it a valuable component in the development of novel chemical entities with potential applications in various industries, including pharmaceuticals, agrochemicals, and materials science.
Used in Chemical Research:
In addition to its practical applications, 3-Bromo-5-(prop-1-en-2-yl)pyridine is also used in chemical research to explore new synthetic routes, reaction mechanisms, and the development of innovative catalysts and methodologies. Its unique structural features make it an interesting subject for academic and industrial research.

Check Digit Verification of cas no

The CAS Registry Mumber 40472-88-6 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 4,0,4,7 and 2 respectively; the second part has 2 digits, 8 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 40472-88:
(7*4)+(6*0)+(5*4)+(4*7)+(3*2)+(2*8)+(1*8)=106
106 % 10 = 6
So 40472-88-6 is a valid CAS Registry Number.

40472-88-6SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 3-Bromo-5-(prop-1-en-2-yl)pyridine

1.2 Other means of identification

Product number -
Other names 3-bromo-5-prop-1-en-2-ylpyridine

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:40472-88-6 SDS

40472-88-6Relevant academic research and scientific papers

Discovery of indazole aldosterone synthase (CYP11B2) inhibitors as potential treatments for hypertension

Hoyt, Scott B.,Taylor, Jerry,London, Clare,Ali, Amjad,Ujjainwalla, Feroze,Tata, Jim,Struthers, Mary,Cully, Doris,Wisniewski, Tom,Ren, Ning,Bopp, Charlene,Sok, Andrea,Verras, Andreas,McMasters, Daniel,Chen, Qing,Tung, Elaine,Tang, Wei,Salituro, Gino,Clemas, Joe,Zhou, Gaochao,MacNeil, Douglas,Duffy, Ruth,Xiong, Yusheng

, p. 2384 - 2388 (2017)

We report the discovery and hit-to-lead optimization of a structurally novel indazole series of CYP11B2 inhibitors. Benchmark compound 34 from this series displays potent inhibition of CYP11B2, high selectivity versus related steroidal and hepatic CYP targets, and lead-like physical and pharmacokinetic properties. On the basis of these and other data, the indazole series was progressed to lead optimization for further refinement.

Discovery of benzimidazole CYP11B2 inhibitors with in vivo activity in rhesus monkeys

Hoyt, Scott B.,Park, Min K.,London, Clare,Xiong, Yusheng,Tata, Jim,Bennett, D. Jonathan,Cooke, Andrew,Cai, Jiaqiang,Carswell, Emma,Robinson, John,MacLean, John,Brown, Lindsay,Belshaw, Simone,Clarkson, Thomas R.,Liu, Kun,Liang, Gui-Bai,Struthers, Mary,Cully, Doris,Wisniewski, Tom,Ren, Ning,Bopp, Charlene,Sok, Andrea,Cai, Tian-Quan,Stribling, Sloan,Pai, Lee-Yuh,Ma, Xiuying,Metzger, Joe,Verras, Andreas,McMasters, Daniel,Chen, Qing,Tung, Elaine,Tang, Wei,Salituro, Gino,Buist, Nicole,Kuethe, Jeff,Rivera, Nelo,Clemas, Joe,Zhou, Gaochao,Gibson, Jack,Maxwell, Carrie Ann,Lassman, Mike,McLaughlin, Theresa,Castro-Perez, Jose,Szeto, Daphne,Forrest, Gail,Hajdu, Richard,Rosenbach, Mark,Ali, Amjad

supporting information, p. 573 - 578 (2015/05/27)

We report the discovery of a benzimidazole series of CYP11B2 inhibitors. Hit-to-lead and lead optimization studies identified compounds such as 32, which displays potent CYP11B2 inhibition, high selectivity versus related CYP targets, and good pharmacokin

INDAZOLE COMPOUNDS AS ALDOSTERONE SYNTHASE INHIBITORS

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Page/Page column 43; 44, (2014/07/08)

This invention relates to indazole compounds of the structural formula: (structure represented) or their pharmaceutically acceptable salts, wherein the variable are defined herein. The inventive compounds selectively inhibit aldosterone synthase. This invention also provides for pharmaceutical compositions comprising the compounds of Formula I or their salts as well as potentially to methods for the treatment or amelioration of conditions that could be treated by inhibiting aldosterone synthase.

TRIAZOLOPYRIDYL COMPOUNDS AS ALDOSTERONE SYNTHASE INHIBITORS

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Page/Page column 41, (2013/04/10)

This invention relates to triazolopyridyl compounds of the structural formula: [Formula should be inserted here] or their pharmaceutically acceptable salts, wherein the variable are defined herein. The inventive compounds selectively inhibit aldosterone synthase. This invention also provides for pharmaceutical compositions comprising the compounds of Formula I or their salts as well as potentially to methods for the treatment, amelioration or prevention of conditions that could be treated by inhibiting aldosterone synthase.

PYRAZOLOPYRIDYL COMPOUNDS AS ALDOSTERONE SYNTHASE INHIBITORS

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Page/Page column 39, (2013/04/10)

This invention relates to pyrazolopyridyl compounds of the structural formula: [Formula should be inserted here] or their pharmaceutically acceptable salts, wherein the variable are defined herein. The inventive compounds selectively inhibit aldosterone s

IMIDAZOPYRIDYL COMPOUNDS AS ALDOSTERONE SYNTHASE INHIBITORS

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Page/Page column 36, (2013/04/10)

This invention relates to imidazopyridyl compounds of the structural formula: I or their pharmaceutically acceptable salts, wherein the variable are defined herein. The inventive compounds selectively inhibit aldosterone synthase. This invention also provides for pharmaceutical compositions comprising the compounds of Formula I or their salts as well as potentially to methods for the treatment, amelioration or prevention of conditions that could be treated by inhibiting aldosterone synthase.

ALDOSTERONE SYNTHASE INHIBITORS

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Page/Page column 69, (2012/11/13)

This invention relates to tricyclic triazole analogues of the formula I or their pharmaceutically acceptable salts, wherein the variable are defined herein. The inventive compounds selectively inhibit aldosterone synthetase. This invention also provides for pharmaceutical compositions comprising the compounds of Formula I or their salts as well as to methods for the treatment, amelioration or prevention of conditions that could be treated by inhibiting aldosterone synthetase.

PI3 KINASE/mTOR DUAL INHIBITOR

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Page/Page column 3, (2012/07/28)

The present invention provides an imidazo[4,5-c]quinolin-2-one compound, or a pharmaceutically acceptable salt thereof, that inhibits both PI3K and mTOR and, therefore, is useful in the treatment of cancer.

ALDOSTERONE SYNTHASE INHIBITORS

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Page/Page column 38-39, (2012/02/05)

The invention involves compounds of structural Formula (I) and the pharmaceutically acceptable salts thereof. The compounds of the invention are effective at selectively inhibiting CYP11B2, and are therefore useful for the treatment or prophylaxis of disorders that are associated with elevated aldosterone levels, including, but not limited to, hypertension and heart failure.

1H-IMIDAZO[4, 5-c]QUINOLINONE COMPOUNDS, USEFUL FOR THE TREATMENT OF PROLIFERATIVE DISEASES

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Page/Page column 152-153, (2010/12/29)

The invention relates to the use of 1 H-imidazo[4,5-c]quinolinone compounds and salts thereof in the treatment of protein and/or lipid kinase dependent diseases and for the manufacture of pharmaceutical preparations for the treatment of said diseases; 1 H-imidazo[4,5-c]quinolinone compounds for use in the treatment of protein and/or lipid kinase dependent diseases; a method of treatment against said diseases, comprising administering the 1 H-imidazo[4,5-c]quinolinone compounds to a warm-blooded animal, especially a human; pharmaceutical preparations comprising an 1 H-imidazo[4,5-c]quinolinone compounds, especially for the treatment of a protein and/or lipid kinase dependent disease; novel 1 H-imidazo[4,5-c]quinolinone compounds; and a process for the preparation of the novel 1 H-imidazo[4,5-c]quinolinone compounds.

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