3-Bromo-4'-chlorobenzophenone

Base Information

• Chemical Name: 3-Bromo-4'-chlorobenzophenone
• CAS No.: 75762-56-0
• Molecular Formula: C13H8BrClO
• Molecular Weight: 295.55900
• Hs Code.: 2914700090
• European Community (EC) Number: 675-389-9
• DSSTox Substance ID: DTXSID50373599
• Wikidata: Q82161823
• Mol file: 75762-56-0.mol

Synonyms:3-Bromo-4'-chlorobenzophenone;75762-56-0;(3-bromophenyl)-(4-chlorophenyl)methanone;Methanone, (3-bromophenyl)(4-chlorophenyl)-;(3-bromophenyl)(4-chlorophenyl)methanone;SCHEMBL9353635;DTXSID50373599;MFCD06201572;AKOS009339057

Chemical Property of 3-Bromo-4'-chlorobenzophenone

Chemical Property:

• Vapor Pressure: 2.51E-06mmHg at 25°C
• Boiling Point: 391.2oC at 760 mmHg
• Flash Point: 190.4oC
• PSA: 17.07000
• Density: 1.51g/cm3
• LogP: 4.33350
• XLogP3: 4.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 293.94471
• Heavy Atom Count: 16
• Complexity: 248

Purity/Quality:

98% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 3-Bromo-4'-chlorobenzophenone

There total 5 articles about 3-Bromo-4'-chlorobenzophenone 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: 67.0%

3-bromobenzoyl chloride (1711-09-7) + chlorobenzene (108-90-7) → (3-bromophenyl)-(4-chlorophenyl)methanone (75762-56-0)

Guidance literature:

With aluminum (III) chloride; at 90 ℃;

DOI:10.1021/jm2015809

Reference yield: 54.0%

o-cyanobromobenzene (2042-37-7) + sodium p-chlorobenzenesulphinate (14752-66-0) → (3-bromophenyl)-(4-chlorophenyl)methanone (75762-56-0)

Guidance literature:

With palladium(II) trifluoroacetate; trifluoroacetic acid; 6-methyl-2,2'-bipyridine; In tetrahydrofuran; water; at 100 ℃; for 1h; Microwave irradiation;

DOI:10.1021/jo501875n

Reference yield: 23.0%

1,3-dibromobenzene (108-36-1) + 4-chloro-N-methoxy-N-methylbenzamide (122334-37-6) → (3-bromophenyl)-(4-chlorophenyl)methanone (75762-56-0)

Guidance literature:

1,3-dibromobenzene; With iodine; magnesium; In diethyl ether; at 20 - 30 ℃; Inert atmosphere;

4-chloro-N-methoxy-N-methylbenzamide; In diethyl ether; at 0 - 20 ℃; Inert atmosphere;

DOI:10.1016/j.bmcl.2009.12.090

upstream raw materials:

1,3-dibromobenzene

4-chloro-N-methoxy-N-methylbenzamide

3-bromobenzoyl chloride

chlorobenzene

Downstream raw materials:

1-bromo-3-(4-chlorobenzyl)benzene

[(3-bromophenyl)-(4-chlorophenyl)ketone]thiosemicarbazone

(4-chlorophenyl)(3-bromophenyl)pyrid-3-yl methanol

Refernces

• 1、 Keenan, Martine,Abbott, Michael J.,Alexander, Paul W.,Armstrong, Tanya,Best, Wayne M.,Berven, Bradley,Botero, Adriana,Chaplin, Jason H.,Charman, Susan A.,Chatelain, Eric,Von Geldern, Thomas W.,Kerfoot, Maria,Khong, Andrea,Nguyen, Tien,McManus, Joshua D.,Morizzi, Julia,Ryan, Eileen,Scandale, Ivan,Thompson, R. Andrew,Wang, Sen Z.,White, Karen L.. "Analogues of fenarimol are potent inhibitors of trypanosoma cruzi and are efficacious in a murine model of chagas disease". supporting information; experimental part. p. 4189 - 4204. Retrieved 2012/07/27.
• 2、 -. "Benzophenones and benzhydrols". . . Retrieved 2008/06/13.