22313-62-8

Basic information

• Product Name: tert-butyl 2-methylperbenzoate
• Synonyms: tert-butyl 2-methylperbenzoate;tert-Butylperoxy 2-methylbenzoate;Benzenecarboperoxoic acid, 2-methyl-, 1,1-dimethylethyl ester;tert.-Butylperoxy-2-methylbenzoat21;2-Methylperbenzoic acid 1,1-dimethylethyl ester;Einecs 244-906-6;tert-Butyl peroxy-o-methylbenzoate
• CAS NO: 22313-62-8
• Molecular Formula: C₁₂H₁₆O₃
• Molecular Weight: 224.25304
• EINECS: 244-906-6
• Mol File: 22313-62-8.mol
• Article Data: 5

Chemical Properties

• Boiling Point: 310.6°Cat760mmHg
• Flash Point: 118°C
• Appearance: /
• Density: 1.043g/cm³
• Vapor Pressure: 0.000595mmHg at 25°C
• Refractive Index: 1.497
• CAS DataBase Reference: tert-butyl 2-methylperbenzoate(CAS DataBase Reference)
• NIST Chemistry Reference: tert-butyl 2-methylperbenzoate(22313-62-8)
• EPA Substance Registry System: tert-butyl 2-methylperbenzoate(22313-62-8)

Safety Data

• Hazardous Substances Data: 22313-62-8(Hazardous Substances Data)

Usage

InChI:InChI=1/C12H16O3/c1-9-7-5-6-8-10(9)11(13)14-15-12(2,3)4/h5-8H,1-4H3

Upstream product

• 75-91-2 tert.-butylhydroperoxide 
• 22364-68-7 2-tolylmethylnitrile 
• 89-95-2 2-methyl-benzyl alcohol 
• 933-88-0 ortho-toluoyl chloride 

Downstream Products

• 851394-51-9 ethyl 6-methyl-2-[(2-methylbenzoyl)oxy]-1,4-dioxaspiro[4.5]decane-6-carboxylate 
• 99968-29-3 2-Methyl-benzoic acid 2-(2-isobutoxycarbonyl-ethyl)-2-isopropyl-[1,3]dioxolan-4-yl ester 
• 99968-28-2 2-Methyl-benzoic acid 2-(2-isobutoxycarbonyl-ethyl)-2-propyl-[1,3]dioxolan-4-yl ester 
• 99968-27-1 2-Methyl-benzoic acid 2-ethyl-2-(2-isobutoxycarbonyl-ethyl)-[1,3]dioxolan-4-yl ester 
• 99968-26-0 2-Methyl-benzoic acid 2-(2-isobutoxycarbonyl-ethyl)-2-methyl-[1,3]dioxolan-4-yl ester 
• 112183-52-5 2-Methyl-benzoic acid 2,2-diphenyl-[1,3]dioxolan-4-yl ester 
• 112183-53-6 2-Methyl-benzoic acid 6,10-dimethyl-1,4-dioxa-spiro[4.5]dec-2-yl ester 
• 112183-54-7 2-Methyl-benzoic acid 6-isopropyl-9-methyl-1,4-dioxa-spiro[4.5]dec-2-yl ester 
• 112183-51-4 2-Methyl-benzoic acid 2,2-diisopropyl-[1,3]dioxolan-4-yl ester 
• 112183-55-8 C₂₀H₂₆O₄ 
• 59953-77-4 2-Methyl-benzoic acid 2,2-dimethyl-[1,3]dioxolan-4-yl ester 

Relevant articles and documents

Temperature-controlled solvent-free selective synthesis of tert-butyl peresters or acids from benzyl cyanides in the presence of the TBHP/Cu(OAc)2 system

Solvent-free room temperature synthesis of tert-butyl peresters was achieved via copper-catalyzed oxidative-coupling of benzyl cyanides with tert-butyl hydroperoxide in short reaction times. Various derivatives of tert-butyl peresters were synthesized by this pathway in good to excellent yields. Further investigation revealed that the above-mentioned protocol is effective for the synthesis of benzoic acid derivatives when the reaction is conducted at 80?°C, under the same reaction conditions.

Enantioselective allylic oxidation of cycloalkenes by using Cu(II)-tris(oxazoline) complex as a catalyst

Optically active copper(II)-tris(oxazoline) complex that was synthesized as a model compound of the active site of non-heme oxygenase, was found to catalyze allylic oxidation of cycloalkenes to give the corresponding 2-cycloalkenyl benzoates with moderate to excellent enantioselectivity (up to 93% ee) under die Kharash-Sosnovsky reaction conditions.

A New Synthesis of 4,5-Unsubstituted 1,3-Dioxoles

A synthesis of 4,5-unsubstituted 1,3-dioxoles in two steps from easily accessible 1,3-dioxolanes is described.