1-[4-(2-Chloroethoxy)phenyl]-2-phenylbutan-1-one

Base Information

• Chemical Name: 1-[4-(2-Chloroethoxy)phenyl]-2-phenylbutan-1-one
• CAS No.: 103628-22-4
• Molecular Formula: C18H19ClO2
• Molecular Weight: 302.801
• Hs Code.: 2914700090
• European Community (EC) Number: 600-461-3
• DSSTox Substance ID: DTXSID60394694
• Nikkaji Number: J362.384J
• Mol file: 103628-22-4.mol

Synonyms:103628-22-4;1-[4-(2-chloroethoxy)phenyl]-2-phenylbutan-1-one;1-[4-(2-CHLOROETHOXY)PHENYL]-2-ETHYL-2-PHENYLETHANONE;1-(4-(2-Chloroethoxy)phenyl)-2-phenylbutan-1-one;SCHEMBL845072;1-[4-(2-Chloroethoxy)phenyl]-2-phenyl-1-butanone;DTXSID60394694;AKOS025393569;SS-4727;CS-0363513;FT-0664681;FT-0664683;A926109

Chemical Property of 1-[4-(2-Chloroethoxy)phenyl]-2-phenylbutan-1-one

Chemical Property:

• Vapor Pressure: 3.99E-08mmHg at 25°C
• Melting Point: 60-63°C
• Boiling Point: 445.3oC at 760 mmHg
• Flash Point: 167.9oC
• PSA: 26.30000
• Density: 1.132g/cm3
• LogP: 4.68070
• Storage Temp.: Refrigerator
• Solubility.: Chloroform, Dichloromethane, DMSO, Methanol
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 302.1073575
• Heavy Atom Count: 21
• Complexity: 304

Purity/Quality:

99%, ^*data from raw suppliers

1-[4-(2-Chloroethoxy)phenyl]-2-ethyl-2-phenylethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C1=CC=CC=C1)C(=O)C2=CC=C(C=C2)OCCCl
• Uses: An intermediate in the syntheis of a metabolite of the anti-cancer drug Tamoxifen.

Technology Process of 1-[4-(2-Chloroethoxy)phenyl]-2-phenylbutan-1-one

There total 7 articles about 1-[4-(2-Chloroethoxy)phenyl]-2-phenylbutan-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: 100.0%

2-Phenylbutyric acid (90-27-7) + 2-chloroethoxybenzene (622-86-6) → 1--2-phenyl-butan-1-one (103628-22-4)

Guidance literature:

With trifluoroacetic anhydride; at 20 ℃;

DOI:10.1016/j.bmcl.2019.126806

Reference yield:

2-Phenylbutyryl chloride (36854-57-6) + 2-chloroethoxybenzene (622-86-6) → 1--2-phenyl-butan-1-one (103628-22-4)

Guidance literature:

With aluminum (III) chloride; In 1,2-dichloro-ethane; at 0 ℃;

DOI:10.1016/j.bmcl.2010.02.024

Reference yield:

phenol (108-95-2,27073-41-2) → 1--2-phenyl-butan-1-one (103628-22-4)

Guidance literature:

Multi-step reaction with 2 steps

1: 85 percent / (n-Bu)4N(+)HSO₄(-) / 1.) 3M aq. NaOH, reflux, 1 h, 2.) 6M aq. NaOH, reflux, 1 h

2: 94 percent / (CF₃CO)2O / 70 h / 20 °C

With trifluoroacetic anhydride; tetra(n-butyl)ammonium hydrogensulfate;

upstream raw materials:

2-Phenylbutyric acid

2-chloroethoxybenzene

phenol

2-Phenoxyethanol

Downstream raw materials:

(E)-1-(4-bromophenyl)-1-<4-(2-chloroethoxy)phenyl>-2-phenyl-1-butene

1-[4-(2-Chloro-ethoxy)-phenyl]-1-(4-iodo-phenyl)-2-phenyl-butan-1-ol

(E)-1-bromo-1-<4-(2-chloroethoxy)phenyl>-2-phenyl-1-butene

(Z)-1-bromo-1-<4-(2-chloroethoxy)phenyl>-2-phenyl-1-butene

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 103628-22-4 1-[4-(2-Chloroethoxy)phenyl]-2-ethyl-2-phenylethanone

Send

Send

Metric Ton KG G Pound L ML

Send

Send