1-(2-Methoxy-5-methylphenyl)-2-methylpropan-1-one

Base Information

• Chemical Name: 1-(2-Methoxy-5-methylphenyl)-2-methylpropan-1-one
• CAS No.: 30574-34-6
• Molecular Formula: C12H16O2
• Molecular Weight: 192.258
• DSSTox Substance ID: DTXSID301234459
• Mol file: 30574-34-6.mol

Synonyms:30574-34-6;1-(2-Methoxy-5-methylphenyl)-2-methylpropan-1-one;1-(2-methoxy-5-methylphenyl)-2-methyl-1-propanone;2,5'-Dimethyl-2'-methoxypropiophenone;SCHEMBL12798715;DTXSID301234459;AKOS009163546

Chemical Property of 1-(2-Methoxy-5-methylphenyl)-2-methylpropan-1-one

Chemical Property:

• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 192.115029749
• Heavy Atom Count: 14
• Complexity: 199

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)OC)C(=O)C(C)C

Technology Process of 1-(2-Methoxy-5-methylphenyl)-2-methylpropan-1-one

There total 4 articles about 1-(2-Methoxy-5-methylphenyl)-2-methylpropan-1-one 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: 92.0%

p-methylanizole (104-93-8) + isobutyryl chloride (79-30-1) → 1-(2-methoxy-5-methyl phenyl)-2-methyl-propane-1-one (30574-34-6)

Guidance literature:

With aluminum (III) chloride; In dichloromethane; at 0 - 20 ℃;

Reference yield:

2-hydroxy-5-methylbenzaldehyde (613-84-3) → 1-(2-methoxy-5-methyl phenyl)-2-methyl-propane-1-one (30574-34-6)

Guidance literature:

Multi-step reaction with 3 steps

1: 90 percent / NaH / tetrahydrofuran / 1 h / 70 °C

2: 75 percent / diethyl ether / 1.) 0 deg C, 1 h, 2.) RT, 2 h

3: 10.4 g / pyridinium chlorochromate (PCC) / CH₂Cl₂

With sodium hydride; pyridinium chlorochromate; In tetrahydrofuran; diethyl ether; dichloromethane;

Reference yield:

2-methoxy-5-methylbenzaldehyde (7083-19-4) → 1-(2-methoxy-5-methyl phenyl)-2-methyl-propane-1-one (30574-34-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 75 percent / diethyl ether / 1.) 0 deg C, 1 h, 2.) RT, 2 h

2: 10.4 g / pyridinium chlorochromate (PCC) / CH₂Cl₂

With pyridinium chlorochromate; In diethyl ether; dichloromethane;

upstream raw materials:

1-(2-hydroxy-5-methylphenyl)-2-methylpropan-1-one

dimethyl sulfate

p-methylanizole

isobutyryl chloride

Downstream raw materials:

3,6-dimethyl-thiochromene-2-thione

5-(2-methoxy-5-methyl-phenyl)-4-methyl-[1,2]dithiol-3-thione

1-Methoxy-3-methyl-2-(2'-methoxy-5'-methylphenyl)-1-buten

5-hydroxy-5-(2'-methoxy-5'-methylphenyl)-6-methylhept-1-ene