26459-51-8

Basic information

• Product Name: (4-TERT-BUTYLPHENYL)BENZOATE
• Synonyms: (4-TERT-BUTYLPHENYL)BENZOATE;(4-TERT-BUTYLPHENYL)BENZOATE 99%
• CAS NO: 26459-51-8
• Molecular Formula: C₁₇H₁₈O₂
• Molecular Weight: 254.32
• Product Categories: Aromatic Esters
• Mol File: 26459-51-8.mol
• Article Data: 13

Chemical Properties

• Appearance: /
• CAS DataBase Reference: (4-TERT-BUTYLPHENYL)BENZOATE(CAS DataBase Reference)
• NIST Chemistry Reference: (4-TERT-BUTYLPHENYL)BENZOATE(26459-51-8)
• EPA Substance Registry System: (4-TERT-BUTYLPHENYL)BENZOATE(26459-51-8)

Safety Data

• Hazardous Substances Data: 26459-51-8(Hazardous Substances Data)

Usage

Description

(4-TERT-BUTYLPHENYL)BENZOATE is an organic compound that features a tert-butylphenyl group attached to a benzoate moiety. It is known for its unique chemical structure and properties, which make it suitable for various applications in different industries.

Uses

Used in Optical Materials Industry:
(4-TERT-BUTYLPHENYL)BENZOATE is used as a component in the production of polycarbonate resins for optical materials. Its chemical structure contributes to the desired properties of the final product, such as transparency, durability, and resistance to impact.
Used in Chemical Synthesis:
(4-TERT-BUTYLPHENYL)BENZOATE is utilized in the preparation of aryl esters through a process involving acridinium-catalyzed photoredox C-O bond cleavage and acidolysis of diaryl ethers with aryl carboxylic acids. This method allows for the efficient synthesis of aryl esters, which are important intermediates in the production of various chemical compounds and pharmaceuticals.

Upstream product

• 98-73-7 4-(1,1-dimethylethyl)benzoic acid 
• 108-95-2 phenol 
• 637-87-6 1-Chloro-4-iodobenzene 
• 1864-94-4 phenyl formate 
• 3972-65-4 1-bromo-4-tert-butylbenzene 
• 939-97-9 4-tert-Butylbenzaldehyde 
• 2751-90-8 tetraphenylphosphonium bromide 
• 98-80-6 phenylboronic acid 
• 64-18-6 formic acid 
• 35779-04-5 1-tert-butyl-4-iodobenzene 
• 201230-82-2 carbon monoxide 
• 36600-66-5 4-tert-butylphenylhydrazine hydrochloride 
• 50-00-0 formaldehyd 
• 1710-98-1 p-tert-butyl benzoyl chloride 

Downstream Products

• 214360-66-4 2-(4-tert-butylphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane 
• 4210-32-6 4-tert-butyl benzonitrile 
• 115933-42-1 tributyl(4-(tert-butyl)phenyl)stannane 
• 111564-56-8 1-(tert-butyl)-4-(3-(4-methoxyphenyl)propyl)benzene 
• 71209-71-7 p-tert-butylpropiophenone 

Relevant articles and documents

Influence of substituents on the infrared stretching frequencies of carbonyl group in esters of benzoic acid

Infrared spectra of 25 substituted phenyl esters of benzoic acid C 6H5CO2C6H4-X (X=H, 3-Cl, 3-F, 3-CN, 3-NO2, 3-CH3, 3-OH, 3-NH2, 4-Cl, 4-F, 4-NO2, 4-CN, 4-

An alternative route for boron phenoxide preparation from arylboronic acid and its application for C[sbnd]O bond formation

An efficient synthetic route to benzyl phenyl ether preparation has been successfully developed via a one-pot synthetic protocol utilizing a combination of arylboronic acids, hydrogen peroxide (H2O2), and benzyl halides. The whole procedure consists of two consecutive reactions, formation of boron phenoxide from arylboronic acids and its nucleophilic attack. A simple operation under mild conditions such as room-temperature ionic liquid (choline hydroxide), aerobic environment, and absence of metal- and base-catalysts has been employed. Expansion to utilize benzyl surrogates was also successfully accomplished.

Palladium-catalyzed aryloxy- and alkoxycarbonylation of aromatic iodides in γ-valerolactone as bio-based solvent

Fossil-based solvents and triethylamine as a toxic and volatile base were successfully replaced with γ-valerolactone as a non-volatile solvent and K2CO3 as inorganic base in the alkoxy- and aryloxycarbonylation of aryl iodides using phosphine-free Pd catalyst systems. By this, the traditional systems were not simply replaced but also significantly improved. In the study, the effects of different reaction parameters, i.e. the use of several other solvents, the temperature, the carbon monoxide pressure, the base and the catalyst concentrations, were evaluated in details on the efficiency of the carbonylations. To gather some information on the mechanism of these reactions, the effects of the electronic parameters (σ) of various aromatic substituents of the aryl iodides as well as the influence of para-substitution of phenol were investigated on the activity. For a comparison, the aryl-substituted aryl iodides were also reacted with methanol and aryl iodide was also alkoxycarbonylated using several different lower alcohols. From the observed correlations between the electronic parameters of the aromatic substituents and the rates, it appears that the rate determining step is the oxidative addition of Ar–I to Pd0, provided that sufficient amounts of nucleophiles are present for the ester formation. If this is not the case, the rate of nucleophile attack might determine the overall rate.