2-Benzyl-1,3-diphenylpropan-1-one

Base Information

• Chemical Name: 2-Benzyl-1,3-diphenylpropan-1-one
• CAS No.: 6624-04-0
• Molecular Formula: C22H20O
• Molecular Weight: 300.4
• NSC Number: 55218
• DSSTox Substance ID: DTXSID60288307
• Nikkaji Number: J831.469A
• Wikidata: Q82024655

Synonyms:2-benzyl-1,3-diphenylpropan-1-one;6624-04-0;NSC55218;NCIOpen2_001986;SCHEMBL6201853;DTXSID60288307;DPRZTHUZFBFMFJ-UHFFFAOYSA-N;NSC-55218;(1,3-Diphenylprop-2-yl)-(phenyl)-ketone

Chemical Property of 2-Benzyl-1,3-diphenylpropan-1-one

Chemical Property:

• Vapor Pressure: 7.77E-09mmHg at 25°C
• Boiling Point: 465.3°Cat760mmHg
• Flash Point: 203.3°C
• Density: 1.089g/cm³
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 300.151415257
• Heavy Atom Count: 23
• Complexity: 323

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC(CC2=CC=CC=C2)C(=O)C3=CC=CC=C3

Technology Process of 2-Benzyl-1,3-diphenylpropan-1-one

There total 59 articles about 2-Benzyl-1,3-diphenylpropan-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: 97.0%

benzyl bromide (100-39-0) + acetophenone (98-86-2) → 2-benzyl-1,3-diphenyl-propan-1-one (6624-04-0)

Guidance literature:

With potassium hydroxide; Aliquat 336; for 20h; Ambient temperature;

DOI:10.1016/S0040-4020(97)00089-6

Reference yield: 95.0%

dihydrochalcone (1083-30-3) + benzyl alcohol (100-51-6,185532-71-2) → 2-benzyl-1,3-diphenyl-propan-1-one (6624-04-0)

Guidance literature:

With 1,10-Phenanthroline; potassium tert-butylate; nickel dibromide; In toluene; at 140 ℃; for 36h; Schlenk technique; Sealed tube; Inert atmosphere;

DOI:10.1021/acs.orglett.8b02256

Reference yield: 94.0%

2-benzyl-1,3-diphenylpropan-1-ol (24547-82-8) → 2-benzyl-1,3-diphenyl-propan-1-one (6624-04-0)

Guidance literature:

With C₃₉H₃₂Cl₃F₆IrN₂; potassium hydroxide; In toluene; at 140 ℃; for 8h;

DOI:10.1021/acs.joc.0c01099

upstream raw materials:

2-benzyl-1,3-diphenylpropan-1-ol

2-benzyl-3-phenylpropanamide

dl-β-amino-β-phenyl-α.α-dibenzyl-ethanol

hippuric acid-(2-benzyl-2-hydroxy-1,3-diphenyl-propylamide)

Downstream raw materials:

2-benzyl-2-methyl-1,3-diphenyl-propan-1-one

2-benzyl-1,3-diphenyl-propane

2,4-Diphenyl-3-benzyl-1-buten

2-(4-Acetyl-benzyl)-3-(4-acetyl-phenyl)-1-phenyl-propan-1-one

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