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1-BROMO-2-(PHENOXYMETHYL)BENZENE 97+% is a white to off-white crystalline solid that is a chemical compound often used in research and industrial applications. With a purity of at least 97%, it is commonly utilized as a reagent in organic synthesis and as an intermediate in the production of various pharmaceuticals and agrochemicals. Additionally, it is known for its use in the development of new materials and as a building block in the creation of advanced polymers. Due to its high purity and versatile applications, 1-BROMO-2-(PHENOXYMETHYL)BENZENE 97+% is a valuable and important chemical in various scientific and industrial fields.

94191-73-8

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94191-73-8 Usage

Uses

Used in Organic Synthesis:
1-BROMO-2-(PHENOXYMETHYL)BENZENE 97+% is used as a reagent in organic synthesis for its ability to facilitate various chemical reactions and contribute to the formation of desired products.
Used in Pharmaceutical Production:
1-BROMO-2-(PHENOXYMETHYL)BENZENE 97+% is used as an intermediate in the production of various pharmaceuticals, playing a crucial role in the synthesis of active ingredients for medications.
Used in Agrochemical Production:
1-BROMO-2-(PHENOXYMETHYL)BENZENE 97+% is used as an intermediate in the production of agrochemicals, contributing to the development of effective products for agricultural applications.
Used in Material Development:
1-BROMO-2-(PHENOXYMETHYL)BENZENE 97+% is used in the development of new materials, showcasing its potential to contribute to the creation of innovative and improved materials for various industries.
Used in Advanced Polymers Creation:
1-BROMO-2-(PHENOXYMETHYL)BENZENE 97+% is used as a building block in the creation of advanced polymers, highlighting its importance in the development of new polymeric materials with enhanced properties.

Check Digit Verification of cas no

The CAS Registry Mumber 94191-73-8 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,4,1,9 and 1 respectively; the second part has 2 digits, 7 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 94191-73:
(7*9)+(6*4)+(5*1)+(4*9)+(3*1)+(2*7)+(1*3)=148
148 % 10 = 8
So 94191-73-8 is a valid CAS Registry Number.
InChI:InChI=1/C13H11BrO/c14-13-9-5-4-6-11(13)10-15-12-7-2-1-3-8-12/h1-9H,10H2

94191-73-8SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name 1-bromo-2-(phenoxymethyl)benzene

1.2 Other means of identification

Product number -
Other names [(2-bromophenyl)methoxy]benzene

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:94191-73-8 SDS

94191-73-8Relevant academic research and scientific papers

Visible light mediated synthesis of 6H-benzo[c]chromenes: transition-metal-free intramolecular direct C-H arylation

Budén, María E.,Heredia, Micaela D.,Puiatti, Marcelo,Rossi, Roberto A.

supporting information, p. 228 - 239 (2021/12/29)

A synthetic approach towards the 6H-benzo[c]chromene ring under visible light and transition-metal-free conditions has been developed. Benzochromenes are synthesized from the corresponding (2-halobenzyl) phenyl ethers or (2-halophenyl) benzyl ethers using

tBuOK-Promoted Cyclization of Imines with Aryl Halides

Li, Ya-Wei,Zheng, Hong-Xing,Yang, Bo,Shan, Xiang-Huan,Qu, Jian-Ping,Kang, Yan-Biao

supporting information, p. 4553 - 4556 (2020/06/08)

A transition-metal-free indole synthesis using radical coupling of 2-halotoluenes and imines via the later-stage C-N bond construction was reported for the first time. It includes an aminyl radical generation by C-H cleaving addition of 2-halotoluenes to imines via the carbanion radical relay and an intramolecular coupling of aryl halides with aminyl radicals. One standard condition can be used for all halides including F, Cl, Br, and I. No extra oxidant or transition metal is required.

Steric Effect of Carboxylate Ligands on Pd-Catalyzed Intramolecular C(sp2)–H and C(sp3)–H Arylation Reactions

Tanji, Yutaka,Mitsutake, Naoya,Fujihara, Tetsuaki,Tsuji, Yasushi

supporting information, p. 10314 - 10317 (2018/08/06)

A bulky carboxylic acid bearing three cyclohexylmethyl substituents at the α-position, namely, tri(cyclohexylmethyl)acetic acid, is demonstrated to act as an efficient ligand source in Pd-catalyzed intramolecular C(sp2)?H and C(sp3)?H arylation reactions. The reactions proceed smoothly under mild reaction conditions, even at room temperature due to the steric bulk of the carboxylate ligands, which accelerates the rate-determining C?H bond activation step in the catalytic cycle.

Strategy for Overcoming Full Reversibility of Intermolecular Radical Addition to Aldehydes: Tandem C-H and C-O Bonds Cleaving Cyclization of (Phenoxymethyl)arenes with Carbonyls to Benzofurans

Zheng, Hong-Xing,Shan, Xiang-Huan,Qu, Jian-Ping,Kang, Yan-Biao

, p. 3310 - 3313 (2018/06/11)

An intermolecular addition of carbon radicals enabled by a cascade radical coupling strategy is developed. It includes an intermolecular alkyl radical addition to a carbonyl group followed by an intramolecular alkoxy radical addition to haloarenes and produces substituted benzofurans in high yields. The radical nature of this reaction is explored by radical trapping experiments and EPR analysis. The mechanism is investigated by KIE experiments and control experiments. This method could provide rapid and practical access to the key intermediate of TAM-16, a safe and potent antibacterial agent for treating tuberculosis, and, therefore, is of great importance for organic synthesis and the pharmaceutical industry.

Au-catalyzed biaryl coupling to generate 5- to 9-membered rings: Turnover-limiting reductive elimination versus π-complexation

Corrie, Tom J. A.,Ball, Liam T.,Russell, Christopher A.,Lloyd-Jones, Guy C.

supporting information, p. 245 - 254 (2017/05/29)

The intramolecular gold-catalyzed arylation of arenes by aryl-trimethylsilanes has been investigated from both mechanistic and preparative aspects. The reaction generates 5- to 9-membered rings, and of the 44 examples studied, 10 include a heteroatom (N, O). Tethering of the arene to the arylsilane provides not only a tool to probe the impact of the conformational flexibility of Ar-Au-Ar intermediates, via systematic modulation of the length of aryl-aryl linkage, but also the ability to arylate neutral and electron-poor arenes-substrates that do not react at all in the intermolecular process. Rendering the arylation intramolecular also results in phenomenologically simpler reaction kinetics, and overall these features have facilitated a detailed study of linear free energy relationships, kinetic isotope effects, and the first quantitative experimental data on the effects of aryl electron demand and conformational freedom on the rate of reductive elimination from diaryl-gold(III) species. The turnover-limiting step for the formation of a series of fluorene derivatives is sensitive to the reactivity of the arene and changes from reductive elimination to π-complexation for arenes bearing strongly electron-withdrawing substituents (σ > 0.43). Reductive elimination is accelerated by electron-donating substituents (ρ = -2.0) on one or both rings, with the individual σ-values being additive in nature. Longer and more flexible tethers between the two aryl rings result in faster reductive elimination from Ar-Au(X)-Ar and lead to the π-complexation of the arene by Ar-AuX2 becoming the turnover-limiting step.

Au-Catalyzed Biaryl Coupling to Generate 5- To 9-Membered Rings: Turnover-Limiting Reductive Elimination versus ?-Complexation

Ball, Liam T.,Corrie, Tom J. A.,Lloyd-Jones, Guy C.,Russell, Christopher A.

supporting information, p. 245 - 254 (2021/09/04)

The intramolecular gold-catalyzed arylation of arenes by aryl-trimethylsilanes has been investigated from both mechanistic and preparative aspects. The reaction generates 5- to 9-membered rings, and of the 44 examples studied, 10 include a heteroatom (N, O). Tethering of the arene to the arylsilane provides not only a tool to probe the impact of the conformational flexibility of Ar-Au-Ar intermediates, via systematic modulation of the length of aryl-aryl linkage, but also the ability to arylate neutral and electron-poor arenes - substrates that do not react at all in the intermolecular process. Rendering the arylation intramolecular also results in phenomenologically simpler reaction kinetics, and overall these features have facilitated a detailed study of linear free energy relationships, kinetic isotope effects, and the first quantitative experimental data on the effects of aryl electron demand and conformational freedom on the rate of reductive elimination from diaryl-gold(III) species. The turnover-limiting step for the formation of a series of fluorene derivatives is sensitive to the reactivity of the arene and changes from reductive elimination to ?-complexation for arenes bearing strongly electron-withdrawing substituents (σ > 0.43). Reductive elimination is accelerated by electron-donating substituents (ρ = -2.0) on one or both rings, with the individual σ-values being additive in nature. Longer and more flexible tethers between the two aryl rings result in faster reductive elimination from Ar-Au(X)-Ar and lead to the ?-complexation of the arene by Ar-AuX2 becoming the turnover-limiting step.

Impregnated palladium on magnetite as catalyst for direct arylation of heterocycles

Cano, Rafael,Pérez, Juana M.,Ramón, Diego J.,McGlacken, Gerard P.

, p. 1043 - 1050 (2016/07/06)

Palladium impregnated on magnetite is an efficient, cheap and easy to prepare catalyst for the direct arylation of heterocycles. Good yields are afforded under relatively mild conditions and a broad substrate scope is evident. The catalyst is regioselective in many cases, affording arylated products, at the C2- or C3-position (depending of the heterocycle used). The methodology can be extended to prepare chromenes through an intramolecular direct arylation reaction. Some evidence is provided for two catalyst deactivation pathways, which prevents efficient recycling.

COMPOUNDS AND METHODS FOR USE IN TREATING NEOPLASIA AND CANCER

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Page/Page column 62, (2013/03/26)

The present invention relates to a novel method for the treatment of neoplasia, including cancer and other diseases and conditions in humans and mammals. More particularly, in preferred aspects, the present invention provides a method for the use of novel compounds for the treatment of neoplasia, hyperproliferative cell growth including psoriasis, restenosis following cardiovascular surgery, hyperplasia, including renal hyperplasia, chronic inflammatory diseases including rheumatoid and osteoarthritis, among others.

Ultrasound-promoted intramolecular direct arylation in a capillary flow microreactor

Zhang, Lei,Geng, Mei,Teng, Peng,Zhao, Dan,Lu, Xi,Li, Jian-Xin

experimental part, p. 250 - 256 (2012/04/23)

An intramolecular direct arylation of various aryl bromides was performed using ultrasonic irradiation and a continuous flow capillary microreactor. The present procedure provided a higher functional group tolerance, ligand-free, milder reaction condition

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