(4-Isobutylphenyl)(phenyl)methanone

Base Information

• Chemical Name: (4-Isobutylphenyl)(phenyl)methanone
• CAS No.: 64357-65-9
• Molecular Formula: C17H18O
• Molecular Weight: 238.329
• DSSTox Substance ID: DTXSID001256553
• Mol file: 64357-65-9.mol

Synonyms:(4-isobutylphenyl)(phenyl)methanone;64357-65-9;[4-(2-methylpropyl)phenyl](phenyl)methanone;4-isobutylbenzophenone;SCHEMBL5018743;YBQSHGZGWSUGJX-UHFFFAOYSA-N;DTXSID001256553;[4-(2-methylpropyl)phenyl]-phenylmethanone;Methanone, [4-(2-methylpropyl)phenyl]phenyl-;A1-27888

Chemical Property of (4-Isobutylphenyl)(phenyl)methanone

Chemical Property:

• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 238.135765193
• Heavy Atom Count: 18
• Complexity: 255

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)CC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Technology Process of (4-Isobutylphenyl)(phenyl)methanone

There total 4 articles about (4-Isobutylphenyl)(phenyl)methanone 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: 58.0%

1-phenyl-2-methylpropane (538-93-2) + benzoic acid anhydride (93-97-0) → (4-isobutylphenyl)(phenyl)methanone (64357-65-9)

Guidance literature:

With trifluoroacetic acid; at 100 ℃; for 56h; Inert atmosphere;

DOI:10.1016/j.tetlet.2018.01.026

Reference yield:

1-phenyl-2-methylpropane (538-93-2) + benzoyl chloride (98-88-4) → (3-isobutyl-phenyl)-phenyl-methanone + (2-methylpropyl)benzophenone + (4-isobutylphenyl)(phenyl)methanone (64357-65-9)

Guidance literature:

With indium(III) chloride; 1-butyl-3-methylimidazolium chloride; at 120 ℃; for 48h; Title compound not separated from byproducts;

DOI:10.1039/b413132k

Reference yield:

1-phenyl-2-methylpropane (538-93-2) + benzoyl chloride (98-88-4) → (4-isobutylphenyl)(phenyl)methanone (64357-65-9)

Guidance literature:

With aluminium trichloride; In carbon disulfide;

upstream raw materials:

1-phenyl-2-methylpropane

benzoyl chloride

benzoic acid anhydride

Downstream raw materials:

4-isobutyl-benzhydryl chloride