Peroxide, 1,1-dimethylethyl ethyl

Base Information

• Chemical Name: Peroxide, 1,1-dimethylethyl ethyl
• CAS No.: 20396-54-7
• Molecular Formula: C6H14 O2
• Molecular Weight: 118.176
• Hs Code.: 2909600000
• DSSTox Substance ID: DTXSID1066605
• Nikkaji Number: J422.064A
• Wikidata: Q81993183
• Mol file: 20396-54-7.mol

Synonyms:2-ethylperoxy-2-methylpropane;Peroxide, 1,1-dimethylethyl ethyl;tert-Butyl ethyl peroxide;20396-54-7;t-butoxy ethanolate;SCHEMBL325976;DTXSID1066605;2-(ethylperoxy)-2-methylpropane;(1,1-Dimethylethyl)ethyl peroxide

Chemical Property of Peroxide, 1,1-dimethylethyl ethyl

Chemical Property:

• Vapor Pressure: 64.7mmHg at 25°C
• Boiling Point: 90°Cat760mmHg
• Flash Point: 20.3°C
• PSA: 18.46000
• Density: 0.841g/cm³
• LogP: 1.75300
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 118.099379685
• Heavy Atom Count: 8
• Complexity: 54

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOOC(C)(C)C

Technology Process of Peroxide, 1,1-dimethylethyl ethyl

There total 2 articles about Peroxide, 1,1-dimethylethyl ethyl which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

tert.-butylhydroperoxide (75-91-2) + triethylbismuth (617-77-6) → diethyl ether (60-29-7,927820-24-4) + (C2H5)2BiOH + ethanol (64-17-5) + t-C4H9OOC2H5 (20396-54-7) + tert-butyl alcohol (75-65-0)

Guidance literature:

In benzene;

DOI:10.1039/J39710001660

Reference yield:

2-tert-butylperoxy-ethyl (54156-77-3) → oxirane (75-21-8,99932-75-9) + t-C4H9OOC2H5 (20396-54-7)

Guidance literature:

With tri-n-butyl-tin hydride; In benzene; at 24.9 ℃; Rate constant; Irradiation;

Reference yield:

t-C4H9OOC2H5 (20396-54-7) + cyclohexene (110-83-8) → formaldehyd (50-00-0,30525-89-4,61233-19-0) + ethanol (64-17-5) + acetone (67-64-1) + tert-butyl alcohol (75-65-0)

Guidance literature:

at 195 ℃; Produkt₅-6:Kohlenmonoxid,Acetaldehyd;

DOI:10.1021/ja01157a089

upstream raw materials:

2-tert-butylperoxy-ethyl

tert.-butylhydroperoxide

triethylbismuth

Downstream raw materials:

formaldehyd

ethanol

acetone

tert-butyl alcohol

Refernces