4'-Bromo-3-phenylpropiophenone

Base Information

• Chemical Name: 4'-Bromo-3-phenylpropiophenone
• CAS No.: 1669-51-8
• Molecular Formula: C15H13BrO
• Molecular Weight: 289.172
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID70483003
• Nikkaji Number: J3.012.456A
• Wikidata: Q82319924
• Mol file: 1669-51-8.mol

Synonyms:4'-BROMO-3-PHENYLPROPIOPHENONE;1669-51-8;1-(4-BROMOPHENYL)-3-PHENYLPROPAN-1-ONE;MFCD01851729;4/'-Bromo-3-phenylpropiophenone;SCHEMBL846895;DTXSID70483003;BAA66951;AKOS009339745;1-Propanone, 1-(4-bromophenyl)-3-phenyl-

Chemical Property of 4'-Bromo-3-phenylpropiophenone

Chemical Property:

• Vapor Pressure: 9.9E-07mmHg at 25°C
• Boiling Point: 403.8oC at 760 mmHg
• Flash Point: 76.6oC
• PSA: 17.07000
• Density: 1.349g/cm3
• LogP: 4.26460
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 288.01498
• Heavy Atom Count: 17
• Complexity: 237

Purity/Quality:

99% ^*data from raw suppliers

4'-Bromo-3-phenylpropiophenone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

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

Technology Process of 4'-Bromo-3-phenylpropiophenone

There total 20 articles about 4'-Bromo-3-phenylpropiophenone 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: 98.0%

1-(4-bromophenyl)-3-phenyl-2-propen-1-one (2403-27-2) → 1‐(4‐bromophenyl)‐3‐phenylpropan‐1‐one (1669-51-8)

Guidance literature:

With diphenylsilane; zinc(II) chloride; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In chloroform; for 3h; Ambient temperature;

DOI:10.1021/ja00283a029

Reference yield: 98.0%

(E)-1-(4-bromophenyl)-3-phenylprop-2-en-1-one (72758-69-1,2403-27-2,22966-23-0) → 1‐(4‐bromophenyl)‐3‐phenylpropan‐1‐one (1669-51-8)

Guidance literature:

With diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate; silica gel; In benzene; at 70 ℃; for 18h;

DOI:10.1246/bcsj.60.4019

Reference yield: 95.0%

para-bromoacetophenone (99-90-1) + benzyl alcohol (100-51-6,185532-71-2) → 1‐(4‐bromophenyl)‐3‐phenylpropan‐1‐one (1669-51-8)

Guidance literature:

With lithium tert-butoxide; In toluene; at 110 ℃; for 12h; Inert atmosphere;

DOI:10.1039/c3ra23221b

upstream raw materials:

phenethylmagnesium bromide

4-bromobenzenecarbonitrile

1-(4-bromophenyl)-3-phenyl-2-propen-1-one

(E)-1-(4-bromophenyl)-3-phenylprop-2-en-1-one

Downstream raw materials:

2-bromo-1-(4-bromophenyl)-3-phenyl-1-propanone

4-(1,1-dimethyl-3-phenyl-propyl)-bromobenzene

(E)-1-(4-bromophenyl)-3-phenylprop-2-en-1-one

3-(p-bromophenyl)indene