35333-26-7

Basic information

• Product Name: 5-(4-BROMOPHENYL)-5-OXOVALERIC ACID
• Synonyms: 5-(4-BROMOPHENYL)-5-OXOVALERIC ACID;OTAVA-BB 1043539;UKRORGSYN-BB BBV-213517
• CAS NO: 35333-26-7
• Molecular Formula: C₁₁H₁₁BrO₃
• Molecular Weight: 271.11
• Mol File: 35333-26-7.mol
• Article Data: 14

Chemical Properties

• Boiling Point: 442.323°C at 760 mmHg
• Flash Point: 221.309°C
• Appearance: /
• Density: 1.495g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.569
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 5-(4-BROMOPHENYL)-5-OXOVALERIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 5-(4-BROMOPHENYL)-5-OXOVALERIC ACID(35333-26-7)
• EPA Substance Registry System: 5-(4-BROMOPHENYL)-5-OXOVALERIC ACID(35333-26-7)

Safety Data

• Hazardous Substances Data: 35333-26-7(Hazardous Substances Data)

Usage

Description

5-(4-BROMOPHENYL)-5-OXOVALERIC ACID is a chemical compound with the molecular formula C10H9BrO3. It is a derivative of valeric acid, containing a 4-bromophenyl group. 5-(4-BROMOPHENYL)-5-OXOVALERIC ACID is often used in research and development, particularly in studies related to organic synthesis, pharmaceuticals, and agrochemicals. It is known for its potential biological activities and therapeutic applications, making it a subject of interest for medicinal chemistry and drug discovery. Its structural features and functional groups make it a valuable building block for the synthesis of various bioactive molecules and pharmaceutical compounds.

Uses

Used in Organic Synthesis:
5-(4-BROMOPHENYL)-5-OXOVALERIC ACID is used as a building block for the synthesis of various bioactive molecules and pharmaceutical compounds. Its unique structural features and functional groups make it a valuable component in the development of new organic compounds with potential applications in various industries.
Used in Pharmaceutical Research and Development:
In the pharmaceutical industry, 5-(4-BROMOPHENYL)-5-OXOVALERIC ACID is used as a key intermediate in the development of new drugs. Its potential biological activities and therapeutic applications make it a promising candidate for drug discovery and medicinal chemistry research.
Used in Agrochemical Research:
5-(4-BROMOPHENYL)-5-OXOVALERIC ACID is also utilized in agrochemical research for the development of new pesticides and other agricultural chemicals. Its unique properties and potential applications make it a valuable tool in the creation of innovative and effective products for the agricultural industry.

InChI:InChI=1/C11H11BrO3/c12-9-6-4-8(5-7-9)10(13)2-1-3-11(14)15/h4-7H,1-3H2,(H,14,15)

Upstream product

• 898792-67-1 5-(4-bromo-phenyl)-5-oxo-pentanoic acid ethyl ester 
• 108-55-4 glutaric anhydride, 
• 108-86-1 bromobenzene 
• 5205-39-0 ethyl glutaroyl chloride 
• 1501-26-4 methyl 4-(chlorocarbonyl)butyrate 
• 90991-23-4 5-(4-bromophenyl)-5-oxopentanoic acid methyl ester 
• 1501-27-5 Pentanedioic acid, monomethyl ester 

Downstream Products

• 102769-18-6 3,4-dihydro-6(p-bromophenyl)-2-pyrone 
• 102769-20-0 5-(4-Bromo-phenyl)-5-oxo-pentanoyl chloride 
• 22647-95-6 5-(4-bromophenyl)pentanoic acid 
• 87779-78-0 3-bromo-6,7,8,9-tetrahydro-5H-benzocyclohepten-5-one 
• 229006-86-4 3-(4-methylphenyl)-6,7,8,9-tetrahydro-5H-benzocyclohepten-5-one 
• 229006-88-6 2-(4-methylphenyl)-6,7-dihydro-5H-benzocycloheptene-8-carboxylic acid 
• 274673-50-6 3-p-tolyl-8,9-dihydro-7H-benzocycloheptene-6-carboxylic acid methyl ester 
• 350022-61-6 5-hydroxy-3-p-tolyl-6,7,8,9-tetrahydro-5H-benzocycloheptene-6-carboxylic acid methyl ester 
• 350022-60-5 5-oxo-3-p-tolyl-6,7,8,9-tetrahydro-5H-benzocycloheptene-6-carboxylic acid methyl ester 
• 229008-40-6 5-hydroxy-3-p-tolyl-6,7,8,9-tetrahydro-5H-benzocycloheptene-6-carboxylic acid 
• 229008-37-1 2-(4-(1-pyrrolidinyl)phenyl)-6,7-dihydro-5H-benzocycloheptene-8-carboxylic acid 
• 229008-36-0 3-(4-pyrrolidin-1-yl-phenyl)-8,9-dihydro-7H-benzocycloheptene-6-carboxylic acid methyl ester 
• 229007-64-1 3-(4-piperidin-1-yl-phenyl)-8,9-dihydro-7H-benzocycloheptene-6-carboxylic acid methyl ester 
• 229007-65-2 2-(4-piperidinophenyl)-6,7-dihydro-5H-benzocycloheptene-8-carboxylic acid 

Relevant articles and documents

Method for synthesizing 4-(4-fluorobenzoyl) butyric acid and analogues thereof in continuous flow microreactor

The invention relates to a method for synthesizing 4-(4-fluorobenzoyl) butyric acid and analogues thereof in a continuous flow microreactor, which comprises the following steps: (1) uniformly mixing a compound 1 and a compound 2 to obtain a homogeneous phase solution A; (2) uniformly mixing aluminum trichloride, a compound 1 and an organic solvent to obtain a homogeneous phase solution B; (3) diluting concentrated hydrochloric acid with water to prepare a solution C; and (4) transferring the homogeneous phase solution A and the homogeneous phase solution B into a first micro-reaction module for a Friedel-Crafts acylation reaction, after the reaction is finished, transferring the obtained reaction solution and the solution C into a second micro-reaction module for quenching reaction, and then performing liquid separation, washing and vacuum concentration to obtain a target compound 3; wherein the specific synthesis route is as follows. By adopting the method disclosed by the invention, the target product can be continuously and rapidly synthesized, aluminum trichloride is not needed for treatment, the reaction condition is mild, the reaction time is short, and the yield is high and reaches 90% or above.

Iridium-Catalyzed Asymmetric Hydrogenation of ?- A nd ?-Ketoacids for Enantioselective Synthesis of ?- A nd ?-Lactones

A highly efficient asymmetric hydrogenation of ?- A nd ?-ketoacids was developed by using a chiral spiro iridium catalyst (S)-1a, affording the optically active ?- A nd ?-hydroxy acids/lactones in high yields with excellent enantioselectivities (up to >99% ee) and turnover numbers (TON up to 100000). This protocol provides an efficient and practical method for enantioselective synthesis of Ezetimibe.

Aryl Boronic Acid Catalysed Dehydrative Substitution of Benzylic Alcohols for C?O Bond Formation

A combination of pentafluorophenylboronic acid and oxalic acid catalyses the dehydrative substitution of benzylic alcohols with a second alcohol to form new C?O bonds. This method has been applied to the intermolecular substitution of benzylic alcohols to form symmetrical ethers, intramolecular cyclisations of diols to form aryl-substituted tetrahydrofuran and tetrahydropyran derivatives, and intermolecular crossed-etherification reactions between two different alcohols. Mechanistic control experiments have identified a potential catalytic intermediate formed between the aryl boronic acid and oxalic acid.