2-Methylhexane-2-peroxol

Base Information

• Chemical Name: 2-Methylhexane-2-peroxol
• CAS No.: 14474-79-4
• Molecular Formula: C7H16O2
• Molecular Weight: 132.203
• Hs Code.: 2909600000
• DSSTox Substance ID: DTXSID40510411
• Nikkaji Number: J91.377D
• Wikidata: Q82368669
• Mol file: 14474-79-4.mol

Synonyms:2-hydroperoxy-2-methylhexane;14474-79-4;1,1-Dimethylpentyl hydroperoxide;2-Methylhexane-2-peroxol;SCHEMBL5549906;DTXSID40510411

Chemical Property of 2-Methylhexane-2-peroxol

Chemical Property:

• PSA: 29.46000
• LogP: 2.44480
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 132.115029749
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCC(C)(C)OO

Technology Process of 2-Methylhexane-2-peroxol

There total 3 articles about 2-Methylhexane-2-peroxol 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: 35.0%

2-methylhexan-2-ol (625-23-0) → 1,1-dimethylpentyl hydroperoxide (14474-79-4)

Guidance literature:

With sulfuric acid; dihydrogen peroxide; In water; for 24h; Ambient temperature;

Reference yield:

2-Methylhexane (591-76-4) → 1,1-dimethylpentyl hydroperoxide (14474-79-4)

Guidance literature:

With oxygen; at 80 ℃; Irradiation_.mit UV-Licht;

Reference yield:

2-Methylhexane (591-76-4) → 1,1-dimethylpentyl hydroperoxide (14474-79-4) + 5-methyl-2-hexyl hydroperoxide (153655-36-8) + 1-isopropyl-butyl hydroperoxide + 2-Methyl-hex-1-yl-hydroperoxide

Guidance literature:

With dihydrogen peroxide; oxygen; [n-Bu₄N]VO₃; 2,3,4,5,6-pentachloroaniline; In acetonitrile; at 50 ℃; Further Variations:; Reagents; Temperatures; Product distribution;

DOI:10.1039/b101442k

upstream raw materials:

2-Methylhexane

2-methylhexan-2-ol

Downstream raw materials:

2-methylhexan-2-ol