Benzene, 1-(1-butoxyethenyl)-4-methyl-

Base Information

• Chemical Name: Benzene, 1-(1-butoxyethenyl)-4-methyl-
• CAS No.: 161835-58-1
• Molecular Formula: C13H18O
• Molecular Weight: 190.285
• DSSTox Substance ID: DTXSID10473741
• Nikkaji Number: J323.754K
• Wikidata: Q82303344
• Mol file: 161835-58-1.mol

Synonyms:Benzene, 1-(1-butoxyethenyl)-4-methyl-;161835-58-1;DTXSID10473741

Chemical Property of Benzene, 1-(1-butoxyethenyl)-4-methyl-

Chemical Property:

• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 190.135765193
• Heavy Atom Count: 14
• Complexity: 166

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCOC(=C)C1=CC=C(C=C1)C

Technology Process of Benzene, 1-(1-butoxyethenyl)-4-methyl-

There total 8 articles about Benzene, 1-(1-butoxyethenyl)-4-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: 52.0%

-butyl vinyl ether (111-34-2,92680-80-3) + para-chlorotoluene (106-43-4) → 1-(1-Butoxy-vinyl)-4-methyl-benzene (161835-58-1) + 1-((E)-2-Butoxy-vinyl)-4-methyl-benzene

Guidance literature:

With N-Methyldicyclohexylamine; tri tert-butylphosphoniumtetrafluoroborate; trans-di(μ-acetato)bis[o-(di-o-tolylphosphino)benzyl]dipalladium(II); In water; N,N-dimethyl-formamide; at 160 ℃; for 1h; microwave irradiation;

DOI:10.1021/jo0602367

Reference yield:

-butyl vinyl ether (111-34-2,92680-80-3) + para-bromotoluene (106-38-7) → 1-(1-Butoxy-vinyl)-4-methyl-benzene (161835-58-1)

Guidance literature:

With triethylamine; palladium diacetate; 1,3-bis-(diphenylphosphino)propane; In N,N-dimethyl-formamide; at 80 ℃; for 8h;

DOI:10.1021/jo00031a029

Reference yield:

-butyl vinyl ether (111-34-2,92680-80-3) + 4-tolyl iodide (624-31-7) → 1-(1-Butoxy-vinyl)-4-methyl-benzene (161835-58-1)

Guidance literature:

With triethylamine; palladium diacetate; 1,3-bis-(diphenylphosphino)propane; In N,N-dimethyl-formamide; at 80 ℃; for 2h;

DOI:10.1021/jo00031a029

upstream raw materials:

-butyl vinyl ether

para-bromotoluene

4-tolyl iodide

p-tolyl triflate

Downstream raw materials:

para-methylacetophenone