3-(3-Methoxyphenyl)propiophenone

Base Information

• Chemical Name: 3-(3-Methoxyphenyl)propiophenone
• CAS No.: 15101-68-5
• Molecular Formula: C16H16 O2
• Molecular Weight: 240.302
• NSC Number: 179364
• DSSTox Substance ID: DTXSID00306695
• Nikkaji Number: J3.118.855E
• Wikidata: Q82053900
• Mol file: 15101-68-5.mol

Synonyms:3-(3-METHOXYPHENYL)PROPIOPHENONE;15101-68-5;3-(3-methoxyphenyl)-1-phenylpropan-1-one;MFCD03843095;NSC179364;DTXSID00306695;AKOS009391910;NSC-179364

Chemical Property of 3-(3-Methoxyphenyl)propiophenone

Chemical Property:

• Vapor Pressure: 2.43E-06mmHg at 25°C
• Melting Point: 67-68 °C
• Boiling Point: 391.6°Cat760mmHg
• Flash Point: 174.8°C
• PSA: 26.30000
• Density: 1.081g/cm³
• LogP: 3.51070
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 240.115029749
• Heavy Atom Count: 18
• Complexity: 256

Purity/Quality:

97% ^*data from raw suppliers

3-(3-methoxyphenyl)propiophenone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: COC1=CC=CC(=C1)CCC(=O)C2=CC=CC=C2

Technology Process of 3-(3-Methoxyphenyl)propiophenone

There total 17 articles about 3-(3-Methoxyphenyl)propiophenone 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%

m-methoxychalcone (5470-91-7,22966-05-8) → 1-phenyl-3-(3-(methoxy)phenyl)propan-1-one (15101-68-5)

Guidance literature:

With palladium on activated charcoal; hydrogen; In ethyl acetate; at 20 ℃;

DOI:10.1016/j.ejmech.2016.07.047

Reference yield: 97.0%

3-methoxybenzyl alcohol (6971-51-3) + acetophenone (98-86-2) → 1-phenyl-3-(3-(methoxy)phenyl)propan-1-one (15101-68-5)

Guidance literature:

With potassium phosphate tribasic trihydrate; C₃₉H₃₂Cl₂N₅PRu; In tert-Amyl alcohol; at 120 ℃; for 4h; Inert atmosphere; Schlenk technique;

DOI:10.1021/acs.joc.8b00013

Reference yield: 96.0%

3-methoxy-chalcone (5470-91-7) → 1-phenyl-3-(3-(methoxy)phenyl)propan-1-one (15101-68-5)

Guidance literature:

With diethyl 2,6-dimethyl-1,4-dihydropyridine-3,5-dicarboxylate; ephedrine; In toluene; at 60 ℃; for 48h; chemoselective reaction; Inert atmosphere;

DOI:10.14233/ajchem.2018.21480

upstream raw materials:

3-methoxy-chalcone

3-methoxy-1-iodobenzene

(5S)-2,2-dimethyl-4-methylene-5-phenyl-1,3-dioxolane

(S)-(+)-2,2-dimethyl-5-phenyl-1,3-dioxolan-4-one

Downstream raw materials:

3-phenyl-6-methoxy-1H-indene

[2-(5-Methoxy-1-phenyl-indan-1-yl)-ethyl]-dimethyl-amine