(2-Bromo-5-methoxyphenyl)(phenyl)methanone

Base Information

• Chemical Name: (2-Bromo-5-methoxyphenyl)(phenyl)methanone
• CAS No.: 60080-98-0
• Molecular Formula: C14H11BrO2
• Molecular Weight: 291.144
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID00488268
• Nikkaji Number: J1.565.571B
• Wikidata: Q82330830
• Mol file: 60080-98-0.mol

Synonyms:60080-98-0;(2-Bromo-5-methoxyphenyl)(phenyl)methanone;2-BROMO-5-METHOXYBENZOPHENONE;(2-bromo-5-methoxyphenyl)-phenylmethanone;MFCD00672036;DTXSID00488268;AMY10141;AKOS016017836;DS-7393;(2-bromo-5-methoxyphenyl)phenylmethanone;2-bromo-5-methoxybenzophenone, AldrichCPR;CS-0150502;FT-0746897

Chemical Property of (2-Bromo-5-methoxyphenyl)(phenyl)methanone

Chemical Property:

• Vapor Pressure: 1.72E-06mmHg at 25°C
• Melting Point: 42-44 °C(Solv: ligroine (8032-32-4))
• Boiling Point: 396.3oC at 760 mmHg
• Flash Point: 193.5oC
• PSA: 26.30000
• Density: 1.401g/cm3
• LogP: 3.68870
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 289.99424
• Heavy Atom Count: 17
• Complexity: 261

Purity/Quality:

97% ^*data from raw suppliers

2-Bromo-5-methoxybenzophenone 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of (2-Bromo-5-methoxyphenyl)(phenyl)methanone

There total 9 articles about (2-Bromo-5-methoxyphenyl)(phenyl)methanone 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: 96.0%

(2-bromo-5-methoxyphenyl)(phenyl)methanol (60080-99-1) → (2-bromo-5-methoxyphenyl)(phenyl)methanone (60080-98-0)

Guidance literature:

With silica gel; pyridinium chlorochromate; In dichloromethane; at 20 ℃; for 2h; Inert atmosphere;

DOI:10.1021/jo402763m

Reference yield: 64.0%

2-bromo-5-methoxy-benzoic acid (22921-68-2) + benzene (71-43-2,26181-88-4,54682-86-9,13967-78-7,174973-66-1) → (2-bromo-5-methoxyphenyl)(phenyl)methanone (60080-98-0)

Guidance literature:

2-bromo-5-methoxy-benzoic acid; With thionyl chloride; at 80 ℃; for 2h; Inert atmosphere;

benzene; With aluminum (III) chloride; at 80 ℃; for 1h; Inert atmosphere;

DOI:10.1002/ejoc.201301599 DOI:10.1002/ejoc.201301599

Reference yield:

2-bromo-5-methoxy-benzoic acid (22921-68-2) → (2-bromo-5-methoxyphenyl)(phenyl)methanone (60080-98-0)

Guidance literature:

Multi-step reaction with 2 steps

1: thionyl chloride / CHCl₃ / 3 h / Heating

2: 2.3 g / aluminum chloride / 6 h / Heating

With aluminium trichloride; thionyl chloride; In chloroform;

DOI:10.1016/j.tet.2007.01.010

upstream raw materials:

phenylmagnesium chloride

2-bromo-N,5-dimethoxy-N-methylbenzamide

2-bromo-5-methoxybenzoyl chloride

benzene

Downstream raw materials:

(2-bromo-5-methoxyphenyl)(diphenyl)methanol

1-(2-bromo-5-methoxyphenyl)-1-phenylethanol

1-(2-bromo-5-methoxyphenyl)-1-phenylbut-3-en-1-ol

1-(2-bromo-5-methoxyphenyl)-1-phenylprop-2-yn-1-ol