22313-60-6

Basic information

• Product Name: Benzenecarboperoxoic acid, 4-methyl-, 1,1-dimethylethyl ester
• CAS NO: 22313-60-6
• Molecular Formula: C12H16O3
• Molecular Weight: 208.257
• Mol File: 22313-60-6.mol
• Article Data: 5

Chemical Properties

• CAS DataBase Reference: Benzenecarboperoxoic acid, 4-methyl-, 1,1-dimethylethyl ester(CAS DataBase Reference)
• NIST Chemistry Reference: Benzenecarboperoxoic acid, 4-methyl-, 1,1-dimethylethyl ester(22313-60-6)
• EPA Substance Registry System: Benzenecarboperoxoic acid, 4-methyl-, 1,1-dimethylethyl ester(22313-60-6)

Safety Data

• Hazardous Substances Data: 22313-60-6(Hazardous Substances Data)

Upstream product

• 104-87-0 4-methyl-benzaldehyde 
• 75-91-2 tert.-butylhydroperoxide 
• 589-18-4 4-Methylbenzyl alcohol 
• 99-94-5 p-Toluic acid 
• 106-42-3 para-xylene 
• 106-43-4 para-chlorotoluene 
• 10347-11-2 4-(methylbenzoyl)imidazoline 

Downstream Products

• 103437-97-4 cyclohex-2-en-1-yl 4-methylbenzoate 
• 68175-34-8 1-(tert-butyl)-4-(prop-1-en-1-yl)benzene 
• 1380825-61-5 4-methylbenzoic acid [1,4]dioxan-2-yl ester 
• 135360-09-7 (methylthio)methyl 4-methylbenzoate 

Relevant articles and documents

A Woven Supramolecular Metal-Organic Framework Comprising a Ruthenium Bis(terpyridine) Complex and Cucurbit[8]uril: Enhanced Catalytic Activity toward Alcohol Oxidation

The self-assembly of a diamondoid woven supramolecular metal–organic framework wSMOF-1 has been achieved from intertwined [Ru(tpy)2]2+ (tpy=2,2′,6′,2′′-terpyridine) complex M1 and cucurbit[8]uril (CB[8]) in water, where the intermolecular dimers formed by the appended aromatic arms of M1 are encapsulated in CB[8]. wSMOF-1 exhibits ordered pore periodicity in both water and the solid state, as confirmed by a combination of 1H NMR spectroscopy, UV-vis absorption, isothermal titration calorimetry, dynamic light scattering, small angle X-ray scattering and selected area electron diffraction experiments. The woven framework has a pore aperture of 2.1 nm, which allows for the free access of both secondary and primary alcohols and tert-butyl hydroperoxide (TBHP). Compared with the control molecule [Ru(tpy)2]Cl2, the [Ru(tpy)2]2+ unit of wSMOF-1 exhibits a remarkably higher heterogeneous catalysis activity for the oxidation of alcohols by TBHP in n-hexane. For the oxidation of 1-phenylethan-1-ol, the yield of acetophenone was increased from 10 percent to 95 percent.

Microfluidic Synthesis of tert-Butyl Peresters via KI-Catalyzed Oxidative Coupling of Methyl Arenes and tert-Butyl Hydroperoxide

A green and efficient organic-aqueous two-phase reaction route for the synthesis of tert-butyl peresters by KI-catalyzed C-H oxidation of methyl arenes in a microfluidic chip reactor has been developed. Moreover, a series of tert-butyl perester products were obtained in moderate to good yields under metal-free conditions. A scale-up continuous flow system was constructed to verify the application of this method.

Synthesis of tert-butyl peresters from aldehydes by Bu4NI- catalyzed metal-free oxidation and its combination with the Kharasch-Sosnovsky reaction

A new tert-butyl peresters synthesis directly from aldehydes and TBHP was developed via Bu4NI-catalyzed aldehyde C-H oxidation. Mechanistic studies suggest that the protocol proceeds via a radical process. Combining the method with the Kharasch-Sosnovsky reaction offers a practical approach for the synthesis of allylic esters from simple aldehydes and alkenes via a two-step one-pot procedure.