Hydroperoxide, phenyl[(1,1,2-trimethyl-2-propenyl)dioxy]methyl

Base Information

• Chemical Name: Hydroperoxide, phenyl[(1,1,2-trimethyl-2-propenyl)dioxy]methyl
• CAS No.: 213337-43-0
• Molecular Formula: C₁₃H₁₈O₄
• Molecular Weight: 238.284
• DSSTox Substance ID: DTXSID401178454
• Mol file: 213337-43-0.mol

Synonyms:DTXSID401178454;Hydroperoxide, phenyl[(1,1,2-trimethyl-2-propenyl)dioxy]methyl;213337-43-0

Chemical Property of Hydroperoxide, phenyl[(1,1,2-trimethyl-2-propenyl)dioxy]methyl

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 238.12050905
• Heavy Atom Count: 17
• Complexity: 244

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(=C)C(C)(C)OOC(C1=CC=CC=C1)OO

Technology Process of Hydroperoxide, phenyl[(1,1,2-trimethyl-2-propenyl)dioxy]methyl

There total 1 articles about Hydroperoxide, phenyl[(1,1,2-trimethyl-2-propenyl)dioxy]methyl 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: 49.0%

2,3-dimethylbut-3-en-2-ylhydroperoxide (13249-73-5) + 1-(2-methoxyvinyl)benzene (4747-15-3) → 1-(1,1,2-trimethyl-2-propenylperoxy)benzyl hydroperoxide (213337-43-0)

Guidance literature:

In dichloromethane; at -78 ℃;

DOI:10.1016/S0040-4039(98)01375-6

Reference yield:

1-(1,1,2-trimethyl-2-propenylperoxy)benzyl hydroperoxide (213337-43-0) → (3R,6R)-6,7,7-Trimethyl-3-phenyl-[1,2,4,5]tetroxepan-6-yl-hydroperoxide + (3S,6R)-6,7,7-Trimethyl-3-phenyl-[1,2,4,5]tetroxepan-6-yl-hydroperoxide

Guidance literature:

With ozone; In dichloromethane; acetic acid; at -78 ℃; Yield given. Yields of byproduct given;

DOI:10.1016/S0040-4039(98)01375-6

upstream raw materials:

2,3-dimethylbut-3-en-2-ylhydroperoxide

1-(2-methoxyvinyl)benzene