1-(2-Phenoxyphenyl)ethanone

Base Information

• Chemical Name: 1-(2-Phenoxyphenyl)ethanone
• CAS No.: 26388-13-6
• Molecular Formula: C14H12O2
• Molecular Weight: 212.248
• Hs Code.: 2914509090
• DSSTox Substance ID: DTXSID80443739
• Nikkaji Number: J2.770.382H
• Wikidata: Q82261680
• Mol file: 26388-13-6.mol

Synonyms:1-(2-phenoxyphenyl)ethanone;26388-13-6;2'-Phenoxyacetophenone;1-(2-phenoxyphenyl)ethan-1-one;Ethanone, 1-(2-phenoxyphenyl)-;1-(2-PHENOXYPHENYL)-ETHANONE;MFCD08271961;2-Acetyldiphenyl ether;SCHEMBL3179214;Ethanone,1-(2-phenoxyphenyl)-;DTXSID80443739;BBA38813;AKOS000219425;AB90390;AS-77204;SY039794;CS-0313614;A50615;2 inverted exclamation mark -Phenoxyacetophenone;JPG

Chemical Property of 1-(2-Phenoxyphenyl)ethanone

Chemical Property:

• Vapor Pressure: 0.001mmHg at 25°C
• Melting Point: 132 °C
• Refractive Index: 1.569
• Boiling Point: 310.029 °C at 760 mmHg
• Flash Point: 131.672 °C
• PSA: 26.30000
• Density: 1.108 g/cm³
• LogP: 3.68150
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 212.083729621
• Heavy Atom Count: 16
• Complexity: 231

Purity/Quality:

98%min ^*data from raw suppliers

1-(2-Phenoxyphenyl)ethanone ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)C1=CC=CC=C1OC2=CC=CC=C2
• Uses: 1-(2-Phenoxyphenyl)-ethanone is used as a reactant in the preparation of imidazo[1,2-a]pyrazines as inhibitors of bacterial type IV secretion.

Technology Process of 1-(2-Phenoxyphenyl)ethanone

There total 7 articles about 1-(2-Phenoxyphenyl)ethanone 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: 73.0%

diphenylether (101-84-8) + acetic acid (64-19-7,77671-22-8) → 1-(2-phenoxyphenyl)ethan-1-one (26388-13-6)

Guidance literature:

With [bis(acetoxy)iodo]benzene; In chlorobenzene; at 130 ℃; for 3h; Sealed tube;

DOI:10.1002/aoc.6236

Reference yield: 72.0%

2'-Fluoroacetophenone (445-27-2) + phenol (108-95-2,27073-41-2) → 1-(2-phenoxyphenyl)ethan-1-one (26388-13-6)

Guidance literature:

With potassium carbonate; In N,N-dimethyl acetamide; at 170 ℃; for 4h; Inert atmosphere;

DOI:10.1002/anie.201409982

Reference yield: 71.0%

1-(2-chlorophenyl)ethanone (2142-68-9) + phenol (108-95-2,27073-41-2) → 1-(2-phenoxyphenyl)ethan-1-one (26388-13-6)

Guidance literature:

With copper; potassium carbonate; for 10h; Heating;

DOI:10.1021/jm00349a018

upstream raw materials:

1-(2-chlorophenyl)ethanone

potassium phenolate

phenol

2'-Fluoroacetophenone

Downstream raw materials:

2'-phenoxyacetophenone O-methyloxime

4-methyl-N-[2-(2-phenoxyphenyl)imidazo[1,2-a]pyrazine-8-yl]benzenesulfonamide

8-chloro-2-(2-phenoxyphenyl)imidazo[1,2-a]pyrazine

4-methyl-N-[2-(phenoxyphenyl)imidazo[1,2-a]pyrazine-8-yl]benzenesulfonamide

Refernces

• 1、 -. "CYANO-SUBTITUTED HETEROCYCLES WITH ACTIVITY AS INHIBITORS OF USP30". Page/Page column 48; 49. . Retrieved 2018/04/17.
• 2、 Liu, Zhenxing,Tan, Haocheng,Wang, Long,Fu, Tianren,Xia, Ying,Zhang, Yan,Wang, Jianbo. "Transition-metal-free intramolecular carbene aromatic substitution/Büchner reaction: Synthesis of fluorenes and [6,5,7]benzo-fused rings". supporting information. p. 3056 - 3060. Retrieved 2015/03/30.