3,3-Diphenylpropiophenone

Base Information

• Chemical Name: 3,3-Diphenylpropiophenone
• CAS No.: 606-86-0
• Molecular Formula: C21H18 O
• Molecular Weight: 286.373
• Hs Code.: 2914399090
• European Community (EC) Number: 637-413-6
• NSC Number: 404343,28494,1968
• DSSTox Substance ID: DTXSID60209411
• Nikkaji Number: J130.686C
• Wikidata: Q83083683
• Mol file: 606-86-0.mol

Synonyms:1,3,3-triphenylpropan-1-one;3,3-Diphenylpropiophenone;606-86-0;1-Propanone, 1,3,3-triphenyl-;Propiophenone, 3,3-diphenyl-;1,3,3-Triphenyl-1-propanone;BRN 1881697;AI3-17981;Propiophenone,3-diphenyl-;4-07-00-01834 (Beilstein Handbook Reference);1-Propanone,3,3-triphenyl-;NSC1968;Oprea1_610965;Beta,beta-diphenylpropiophenone;SCHEMBL6200667;1,3,3-triphenyl-propan-1-one;DTXSID60209411;1,3,3-Triphenyl-1-propanone #;NSC 1968;NSC-1968;NSC28494;MFCD00065008;NSC 28494;NSC-28494;NSC404343;STK208435;AKOS005416352;NSC 404343;NSC-404343;LS-125227;FT-0655423;A832840

Chemical Property of 3,3-Diphenylpropiophenone

Chemical Property:

• Vapor Pressure: 1.97E-08mmHg at 25°C
• Boiling Point: 454°C at 760 mmHg
• Flash Point: 199.1°C
• PSA: 17.07000
• Density: 1.092g/cm³
• LogP: 5.09150
• XLogP3: 4.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 286.135765193
• Heavy Atom Count: 22
• Complexity: 312

Purity/Quality:

98%min ^*data from raw suppliers

3,3-DIPHENYLPROPIOPHENONE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

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

Technology Process of 3,3-Diphenylpropiophenone

There total 193 articles about 3,3-Diphenylpropiophenone 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: 99.0%

1,3-diphenyl-propen-3-one (614-47-1) + phenylboronic acid (98-80-6) → 1,3,3-triphenylpropan-1-one (606-86-0)

Guidance literature:

With 1,5-cis,cis-cyclooctadiene; rhodium-grafted hydrotalcite; In 1,4-dioxane; at 150 ℃; for 24h;

DOI:10.1016/j.tetlet.2006.05.075

Reference yield: 98.0%

N-tosyldiphenylmethylamine (853-83-8) + 3-oxo-3-phenylpropionic acid (614-20-0) → 1,3,3-triphenylpropan-1-one (606-86-0)

Guidance literature:

With iron(III) chloride; In 1,2-dichloro-ethane; at 60 ℃; for 1.5h; regioselective reaction;

DOI:10.1039/c1cc12790j

Reference yield: 92.0%

1,1-Diphenylmethanol (91-01-0) + 3-oxo-3-phenylpropionic acid (614-20-0) → 1,3,3-triphenylpropan-1-one (606-86-0)

Guidance literature:

With iodine; In nitromethane; at 70 ℃; for 2h; Temperature; Solvent; Catalytic behavior; Schlenk technique;

DOI:10.1039/c5ob01730k

upstream raw materials:

methyl magnesium iodide

2-bromo-1,3,3-triphenyl-1-propanone

diethyl ether

α-methoxystyrene

Downstream raw materials:

(Z)-1-acetyloxy-1,3,3-triphenyl-1-propene

2-methyl-1,3,3-triphenyl-propan-1-one

2-benzhydryl-3-chloro-1,3-diphenyl-propan-1-one

benzophenone

Refernces

• 1、 Feng, Juhua,Hu, Haipeng,Ni, Hailiang,Qiu, Yuqian,Wang, Cuilin,Wang, Guangtu,Wang, Hanguang,Wang, Wei,Wu, Xin,Yue, Guizhou,Zou, Ping. "Arylboronic Acid Catalyzed Dehydrative Mono-/Dialkylation Reactions of β-Ketoacids and Alcohols". supporting information. p. 832 - 836. Retrieved 2022/02/05.
• 2、 Semba, Kazuhiko,Ohta, Naoki,Paulus, Fritz,Ohata, Masaki,Nakao, Yoshiaki. "Merging Pd0/PdII Redox and PdII/PdII Non-redox Catalytic Cycles for the Allylarylation of Electron-Deficient Alkenes". supporting information. p. 5035 - 5040. Retrieved 2021/02/26.