Ethanone, 1-[3-(2-methyl-1-buten-3-ynyl)oxiranyl]-, [2alpha,3beta(Z)]- (9CI)

Base Information

• Chemical Name: Ethanone, 1-[3-(2-methyl-1-buten-3-ynyl)oxiranyl]-, [2alpha,3beta(Z)]- (9CI)
• CAS No.: 111399-76-9
• Molecular Formula: C₉H₁₀O₂
• Molecular Weight: 150.177
• Mol file: 111399-76-9.mol

Synonyms:Ethanone, 1-[3-(2-methyl-1-buten-3-ynyl)oxiranyl]-, [2alpha,3beta(Z)]- (9CI)

Chemical Property of Ethanone, 1-[3-(2-methyl-1-buten-3-ynyl)oxiranyl]-, [2alpha,3beta(Z)]- (9CI)

Chemical Property:

• PSA: 29.60000
• LogP: 0.92230

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Ethanone, 1-[3-(2-methyl-1-buten-3-ynyl)oxiranyl]-, [2alpha,3beta(Z)]- (9CI)

There total 2 articles about Ethanone, 1-[3-(2-methyl-1-buten-3-ynyl)oxiranyl]-, [2alpha,3beta(Z)]- (9CI) 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:

(3E,5Z)-6-methyl-octa-3,5-dien-7-yn-2-one (58964-85-5) → 1-[3-((Z)-2-Methyl-but-1-en-3-ynyl)-oxiranyl]-ethanone (111399-76-9)

Guidance literature:

With Alkaline; dihydrogen peroxide; Yield given;

DOI:10.1016/S0040-4039(00)96181-1

Reference yield:

(2Z)-3-methyl-2-penten-4-ynal (52421-93-9) → 1-[3-((Z)-2-Methyl-but-1-en-3-ynyl)-oxiranyl]-ethanone (111399-76-9)

Guidance literature:

Multi-step reaction with 2 steps

1: aldol condensation

2: hydrogen peroxide, alkaline

With Alkaline; dihydrogen peroxide;

DOI:10.1016/S0040-4039(00)96181-1

Reference yield:

1-[3-((Z)-2-Methyl-but-1-en-3-ynyl)-oxiranyl]-ethanone (111399-76-9) → (E)-4-(3-Methyl-furan-2-yl)-but-3-en-2-one (111399-78-1,111399-79-2) + (E)-4-(3-Methyl-furan-2-yl)-but-3-en-2-one (111399-78-1) + (E)-3-(5-Methyl-furan-2-yl)-but-2-enal (919301-81-8) + 3-(5-methyl-furan-2-yl)-but-2-enal (111399-80-5)

Guidance literature:

at 350 ℃; for 0.00277778h; Yield given. Further byproducts given. Yields of byproduct given;

DOI:10.1016/S0040-4039(00)96181-1

upstream raw materials:

(3E,5Z)-6-methyl-octa-3,5-dien-7-yn-2-one

(2Z)-3-methyl-2-penten-4-ynal

Downstream raw materials:

(E)-4-(3-Methyl-furan-2-yl)-but-3-en-2-one

(E)-4-(3-Methyl-furan-2-yl)-but-3-en-2-one

(E)-3-(5-Methyl-furan-2-yl)-but-2-enal

3-(5-methyl-furan-2-yl)-but-2-enal