1-[(Butan-2-yl)oxy]-4-methylbenzene

Base Information

• Chemical Name: 1-[(Butan-2-yl)oxy]-4-methylbenzene
• CAS No.: 51241-46-4
• Molecular Formula: C11H16O
• Molecular Weight: 164.247
• DSSTox Substance ID: DTXSID70574925
• Nikkaji Number: J2.324.596E
• Mol file: 51241-46-4.mol

Synonyms:51241-46-4;1-[(Butan-2-yl)oxy]-4-methylbenzene;SCHEMBL8263616;DTXSID70574925;VALIDHVHMWCAQG-UHFFFAOYSA-N;AKOS014094508

Chemical Property of 1-[(Butan-2-yl)oxy]-4-methylbenzene

Chemical Property:

• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 164.120115130
• Heavy Atom Count: 12
• Complexity: 114

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)OC1=CC=C(C=C1)C

Technology Process of 1-[(Butan-2-yl)oxy]-4-methylbenzene

There total 6 articles about 1-[(Butan-2-yl)oxy]-4-methylbenzene 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: 17.0%

p-cresol (106-44-5) + 1-(sec-Butyl)-2,4-diphenyl-5,6-dihydrobenzoquinolinium tetrafluoroborate → 2-sec-butyl-p-cresol (51528-17-7) + p-tolyl s-butyl ether (51241-46-4)

Guidance literature:

at 125 ℃; for 4h;

DOI:10.1039/P29830001435

Reference yield:

sodium 4-methylphenoxide (1121-70-6) → (+)(S)-2-p-tolyloxy-butane (51241-46-4)

Guidance literature:

at 110 - 120 ℃;

DOI:10.1021/ja01323a020

Reference yield:

p-cresol (106-44-5) → p-tolyl s-butyl ether (51241-46-4)

Guidance literature:

Multi-step reaction with 2 steps

1: KOH / acetone

2: H₂ / Pd-CaCO₃

With potassium hydroxide; hydrogen; Lindlar's catalyst; In acetone;

upstream raw materials:

sodium 4-methylphenoxide

s-butyl bromide

p-cresol

4-<1-Methyl-2-propenoxy>-toluol

Downstream raw materials:

sec-Butyl acetate

p-cresol

5-methyl-2-hydroxyacetophenone

butene-2