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BENZENEPROPANOIC ACID, A-BROMO-, ETHYL ESTER, also known as Ethyl α-Bromo-β-phenylpropionate, is an organic compound with the chemical formula C11H13BrO2. It is a yellow liquid and is primarily used in organic synthesis due to its unique chemical properties.

39149-82-1

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39149-82-1 Usage

Uses

Used in Organic Synthesis:
BENZENEPROPANOIC ACID, A-BROMO-, ETHYL ESTER is used as a synthetic intermediate for the production of various organic compounds. Its chemical structure allows it to be a versatile building block in the synthesis of pharmaceuticals, agrochemicals, and other specialty chemicals.
Used in Pharmaceutical Industry:
In the pharmaceutical industry, BENZENEPROPANOIC ACID, A-BROMO-, ETHYL ESTER is used as a key component in the development of new drugs. Its unique structure can be modified to create novel molecules with potential therapeutic applications.
Used in Agrochemical Industry:
BENZENEPROPANOIC ACID, A-BROMO-, ETHYL ESTER is also utilized in the agrochemical industry for the synthesis of new pesticides and other crop protection agents. Its chemical properties make it a valuable starting material for the development of innovative products.
Used in Specialty Chemicals:
In the specialty chemicals sector, BENZENEPROPANOIC ACID, A-BROMO-, ETHYL ESTER is employed as a raw material for the production of various compounds with specific applications, such as dyes, fragrances, and additives for the plastics and coatings industries.

Synthesis Reference(s)

Journal of the American Chemical Society, 71, p. 3107, 1949 DOI: 10.1021/ja01177a049

Check Digit Verification of cas no

The CAS Registry Mumber 39149-82-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,9,1,4 and 9 respectively; the second part has 2 digits, 8 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 39149-82:
(7*3)+(6*9)+(5*1)+(4*4)+(3*9)+(2*8)+(1*2)=141
141 % 10 = 1
So 39149-82-1 is a valid CAS Registry Number.

39149-82-1SDS

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 ethyl 2-bromo-3-phenylpropanoate

1.2 Other means of identification

Product number -
Other names Ethyl Alpha-Bromo-Beta-phenylpropionate

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:39149-82-1 SDS

39149-82-1Relevant academic research and scientific papers

ANTIVIRAL COMPOUNDS

-

Paragraph 088; 089; 090, (2019/04/27)

The present invention relates to novel compounds of general formula (I) wherein R1 to R4 and n have the meanings given in the description and claims, process for preparing these compounds and their use as for treating, preventing or ameliorating viral infections and their use for treating, preventing or ameliorating diseases which are associated with PLA2G16.

Enantioselective intramolecular cyclization of alkynyl esters catalyzed by a chiral Br?nsted base

Kondoh, Azusa,Tran, Hoa Thi Quynh,Kimura, Kyoko,Terada, Masahiro

supporting information, p. 5726 - 5729 (2016/05/19)

An enantioselective intramolecular cyclization reaction of alkynyl esters was developed, which employs a Br?nsted base catalyst generated in situ from a chiral Schiff base and t-BuOK. This reaction is a rare example of the enantioselective intramolecular addition of simple ester enolates to alkynes under Br?nsted base catalysis.

Synthesis of heterocycles from arylation products of unsaturated compounds: XIII. 5-R1-benzyl-2-(R2-2-pyridylimino)thiazolidin-4-ones

Matiichuk,Obushak,Tsyalkovskii

, p. 1050 - 1054 (2007/10/03)

Meerwein reactions of arenediazonium bromides with methyl and ethyl acrylates gave 3-aryl-2-bromopropionic acid esters which were subjected to cyclocondensation with N-(2-pyridyl)- and N-(6-methyl-2-pyridyl) thioureas to obtain 5-R1-benzyl-2-(R

One-pot synthesis of α-bromoesters and ketones from β-ketoesters and diketones using supported reagents system

Aoyama, Tadashi,Takido, Toshio,Kodomari, Mitsuo

, p. 1873 - 1876 (2007/10/03)

A simple and efficient method has been developed for the synthesis of α-bromoesters and ketones from β-ketoesters and diketones in one pot using a supported reagents system, CuBr2/Al2O 3-Na2CO3/Al2O3, in which β-ketoester reacts first with CuBr2/Al2O3 and the product, α-bromo-β-ketoester, reacts with Na 2CO3/Al2O3 to give the final product, α-bromoesters in good yields.

Synthesis of optically pure (S)-2-acetylthio-3-benzenepropanoic acid via enzymatic resolution

Zhu, Jingyang,You, Li,Zhao, Shannon X,White, Brenda,Chen, Jason G,Skonezny, Paul M

, p. 7585 - 7587 (2007/10/03)

A method of synthesizing optically pure (S)-2-acetylthio-3-benzenepropanoic acid has been developed and good to excellent enantiomeric excess achieved via enzymatic resolution.

Novel approaches to optically active substituted 4,5-dihydro-1,2,4-triazin-6(1H)-ones as conformationally constrained peptidomimetics

Saniere, Laurent,Schmitt, Martine,Pellegrini, Nadia,Bourguignon, Jean-Jacques

, p. 671 - 688 (2007/10/03)

Synthesis of 4,5-dihydro-1,2,4-triazin-6-ones bearing different chiral α-amino acid residues at the C3 and N1 positions is reported. Cyclocondensation of N-thioacylphthalimides with α-amino hydrazides afforded C3 functionalised dihydrotriazinones in good

Synthesis of Heterocycles Based of the Products of Anionarylation of Unsaturated Compounds. II. * Method of Preparation of 2,5-Disubstituted 4-Thiazolidones

Obushak,Matiichuk,Ganushchak

, p. 239 - 244 (2007/10/03)

The products of haloarylation of acrylates by aryldiazonium salts (Meerwein reaction) react with thiourea and thiosemicarbazones forming thiazolidone cycle. The reaction is a convenient synthesis method of 5-benzylsubstituted 2-imino-4-thiazolidones and 2

A ONE-POT PREPARATION OF α-HALO-CARBONYL AND α-HALO-SULFONYL COMPOUNDS BY HALO-DEACYLATION

Mignani, G.,Morel, D.,Grass, F.

, p. 5505 - 5508 (2007/10/02)

The reaction of β-ketoesters, β-diketones and β-sulfonylketones with N-halosuccinimides in the presence of a base gives α-halo-carbonyl and α-halo-sulfonyl derivatives by a one-pot halo-deacylation reaction.A facile synthesis of pseudo-ionone is described.

PREPARATION OF α-BROMOESTERS VIA THE HALF ESTERS OF MALONIC ACIDS A NOVEL METHOD FOR RAPID DECARBOXYLATION UNDER MILD CONDITIONS

Goel, O. P.,Krolls, U.

, p. 163 - 166 (2007/10/02)

α-Bromomalonic acid half esters were prepared in high yield and found to be rapidly decarboxylated to α-bromoesters under mild conditions using lithium carbonate in refluxing tetrahydrofuran.

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