1523-17-7

Basic information

• Product Name: (4-bromophenyl) benzoate
• Synonyms: (4-bromophenyl) benzoate
• CAS NO: 1523-17-7
• Molecular Formula: C₁₃H₉BrO₂
• Molecular Weight: 277.11
• Mol File: 1523-17-7.mol
• Article Data: 43

Chemical Properties

• Boiling Point: 359.4°Cat760mmHg
• Flash Point: 171.1°C
• Appearance: /
• Density: 1.465g/cm³
• Vapor Pressure: 2.39E-05mmHg at 25°C
• Refractive Index: 1.61
• CAS DataBase Reference: (4-bromophenyl) benzoate(CAS DataBase Reference)
• NIST Chemistry Reference: (4-bromophenyl) benzoate(1523-17-7)
• EPA Substance Registry System: (4-bromophenyl) benzoate(1523-17-7)

Safety Data

• Hazardous Substances Data: 1523-17-7(Hazardous Substances Data)

Usage

General Description

(4-bromophenyl) benzoate is a chemical compound consisting of a benzene ring with a benzoate ester group attached at one end and a bromine atom attached to the phenyl ring. It is commonly used as a building block in the synthesis of various organic compounds, particularly in pharmaceutical and agrochemical industries. (4-bromophenyl) benzoate is also utilized as an intermediate in the production of fragrances and flavorings. It has the potential to react with a variety of other chemicals to form different and new compounds through esterification and nucleophilic substitution reactions. (4-bromophenyl) benzoate is considered to be a useful and versatile starting material for the creation of a wide range of organic molecules.

InChI:InChI=1/C13H9BrO2/c14-11-6-8-12(9-7-11)16-13(15)10-4-2-1-3-5-10/h1-9H

Upstream product

• 93-99-2 benzoic acid phenyl ester 
• 106-41-2 4-bromo-phenol 
• 98-88-4 benzoyl chloride 
• 7003-65-8 sodium 4-bromophenoxide 
• 98-07-7 Benzotrichlorid 
• 65-85-0 benzoic acid 
• 618-32-6 Benzoyl bromide 
• 67963-68-2 t-butyldimethylsilyl-4-bromophenol 
• 7726-95-6 bromine 
• 7553-56-2 iodine 
• 127-09-3 sodium acetate 
• 64-19-7 acetic acid 
• 93-89-0 benzoic acid ethyl ester 
• 848417-68-5 3,6-dibenzoyloxy-1,2-pyridazine 

Downstream Products

• 55082-33-2 5-bromo-2-hydroxybenzophenone 
• 88681-66-7 Benzoic acid 4-((Z)-2-acetylamino-2-carboxy-vinyl)-phenyl ester 
• 532-32-1 sodium benzoate 
• 7003-65-8 sodium 4-bromophenoxide 
• 93-89-0 benzoic acid ethyl ester 
• 2042-41-3 p-bromophenoxide ion 
• 106-41-2 4-bromo-phenol 
• 69918-18-9 (E)-(5-bromo-2-hydroxyphenyl)(phenyl)methanone oxime 
• 1295567-90-6 4-bromo-2-{α-[1-(4-bromophenyl)benzoimidazol-2-yl]benzyl}phenol 
• 1295567-91-7 4-bromo-2-{α-[1-(4-dimethylaminophenyl)benzoimidazol-2-yl]benzyl}phenol 
• 1295567-92-8 C₂₆H₁₉BrN₂O 
• 1295567-93-9 C₂₄H₁₇BrN₂O₂ 
• 1295567-94-0 4-bromo-2-{α-[1-(2-thienyl)benzoimidazol-2-yl]-benzyl}phenol 
• 1295567-95-1 C₂₆H₁₈BrN₃O₃ 

Relevant articles and documents

Isolation of an inclusion complex of naphthol and its benzoate as an intermediate in the solvent-free benzoylation reaction of naphthol

A study was performed on isolation of an inclusion complex of naphthol and its benzoate as an intermediate in the solvent-free benzoylation reaction of naphthol. Solvent-free benzoylation reactions were carried out by heating a stirred mixture of phenols or naphthols and benzoyl chloride. The structure of the 2 : 1 inclusion complex of 2,3 naphthalenediol and its p-methylbenzoate was studied by X-ray analysis.

Metal-Free Selective Modification of Secondary Amides: Application in Late-Stage Diversification of Peptides

Here we solve a long-standing challenge of the site-selective modification of secondary amides and present a simple two-step, metal-free approach to selectively modify a particular secondary amide in molecules containing multiple primary and secondary amides. Density functional theory (DFT) provides insight into the activation of C-N bonds. This study encompasses distinct chemical advances for late-stage modification of peptides thus harnessing the amides for the incorporation of various functional groups into natural and synthetic molecules.

Mechanically induced solvent-free esterification method at room temperature

Herein, we describe two novel strategies for the synthesis of esters, as achieved under high-speed ball-milling (HSBM) conditions at room temperature. In the presence of I2 and KH2PO2, the reactions afford the desired esterification derivatives in 45% to 91% yields within 20 min of grinding. Meanwhile, using KI and P(OEt)3, esterification products can be obtained in 24% to 85% yields after 60 min of grinding. In addition, the I2/KH2PO2 protocol was successfully extended to the late-stage diversification of natural products showing the robustness of this useful approach. Further application of this method in the synthesis of inositol nicotinate was also discussed. This journal is