3-(2-Hydroxyphenyl)-1,3-diphenylpropan-1-one

Base Information

• Chemical Name: 3-(2-Hydroxyphenyl)-1,3-diphenylpropan-1-one
• CAS No.: 4376-83-4
• Molecular Formula: C21H18O2
• Molecular Weight: 302.36600
• Hs Code.: 2914501900
• DSSTox Substance ID: DTXSID701257776
• Nikkaji Number: J104.098G
• Mol file: 4376-83-4.mol

Synonyms:3-(2-hydroxyphenyl)-1,3-diphenylpropan-1-one;4376-83-4;Propiophenone, 3-(o-hydroxyphenyl)-3-phenyl-;1-Propanone, 3-(2-hydroxyphenyl)-1,3-diphenyl-;SCHEMBL6201030;DTXSID701257776;MFCD00111032;CS-0359460;3-(2-Hydroxyphenyl)-1,3-diphenyl-1-propanone;beta-(2-Hydroxyphenyl)-beta-phenylpropiophenone;3-(2-Hydroxyphenyl)-1,3-diphenyl-1-propanone #

Chemical Property of 3-(2-Hydroxyphenyl)-1,3-diphenylpropan-1-one

Chemical Property:

• PSA: 37.30000
• LogP: 4.79710
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 302.130679813
• Heavy Atom Count: 23
• Complexity: 366

Purity/Quality:

95% ^*data from raw suppliers

3-(2-Hydroxyphenyl)-1,3-diphenylpropan-1-one 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(CC(=O)C2=CC=CC=C2)C3=CC=CC=C3O

Technology Process of 3-(2-Hydroxyphenyl)-1,3-diphenylpropan-1-one

There total 3 articles about 3-(2-Hydroxyphenyl)-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: 54.0%

3-bromo-2H-chromen-2-one (939-18-4) + phenylmagnesium bromide → 3-(o-hydroxyphenyl)-1,3-diphenylpropan-1-one (4376-83-4) + phenyl(3-phenyl-2,3-dihydrobenzofuran-2-yl)methanone (133379-93-8) + 2-bromo-3-(o-hydroxyphenyl)-1,1-diphenylprop-2-en-1-ol (133380-23-1)

Guidance literature:

In toluene; at 0 ℃; for 0.5h;

DOI:10.1039/P19910000203

Reference yield: 50.0%

(2-hydroxyphenyl)mercury chloride (90-03-9) + 1,3-diphenyl-propen-3-one (614-47-1) → 2,4-diphenyl-4H-chromene (53209-37-3,1005391-57-0) + 3-(o-hydroxyphenyl)-1,3-diphenylpropan-1-one (4376-83-4)

Guidance literature:

With hydrogenchloride; tetrabutyl-ammonium chloride; palladium dichloride; In dichloromethane; for 4h; Ambient temperature;

DOI:10.1021/jo00136a036

Reference yield: 21.0%

1,3-diphenyl-propen-3-one (614-47-1) + phenol (108-95-2,27073-41-2) → dihydrochalcone (1083-30-3) + 2,4-diphenyl-4H-chromene (53209-37-3,1005391-57-0) + 3-(o-hydroxyphenyl)-1,3-diphenylpropan-1-one (4376-83-4) + 2,4-diphenyl-2H-chromen-2-ol (1000410-66-1)

Guidance literature:

With trifluoroacetic acid; for 24h; Heating;

DOI:10.1021/jo7015604

upstream raw materials:

3-bromo-2H-chromen-2-one

(2-hydroxyphenyl)mercury chloride

1,3-diphenyl-propen-3-one

phenol

Downstream raw materials:

2,4-diphenyl-4H-chromene