2,6-Dibromophenol acetate

Base Information

• Chemical Name: 2,6-Dibromophenol acetate
• CAS No.: 28165-72-2
• Molecular Formula: C8H6 Br2 O2
• Molecular Weight: 293.942
• DSSTox Substance ID: DTXSID60182432
• Wikidata: Q83053108
• Mol file: 28165-72-2.mol

Synonyms:2,6-Dibromophenol acetate;28165-72-2;2,6-Dibromophenyl acetate;(2,6-dibromophenyl) acetate;Phenol, 2,6-dibromo-, acetate;Phenol,2,6-dibromo-,acetate;starbld0008102;SCHEMBL9646427;DTXSID60182432;Acetic acid, 2,6-dibromophenyl ester;FT-0666514

Chemical Property of 2,6-Dibromophenol acetate

Chemical Property:

• Vapor Pressure: 0.000754mmHg at 25°C
• Boiling Point: 306.8°Cat760mmHg
• Flash Point: 139.3°C
• PSA: 26.30000
• Density: 1.843g/cm³
• LogP: 3.13690
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 293.87141
• Heavy Atom Count: 12
• Complexity: 162

Purity/Quality:

97% ^*data from raw suppliers

2,6-Dibromophenol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=C(C=CC=C1Br)Br

Technology Process of 2,6-Dibromophenol acetate

There total 5 articles about 2,6-Dibromophenol acetate 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%

2,6-dibromophenol (608-33-3) + acetic anhydride (108-24-7) → 1-acetoxy-2,6-dibromobenzene (28165-72-2)

Guidance literature:

With pyridine;

DOI:10.1246/cl.2012.313

Reference yield: 93.0%

Isopropenyl acetate (108-22-5) + 2,6-dibromophenol (608-33-3) → 1-acetoxy-2,6-dibromobenzene (28165-72-2)

Guidance literature:

With methanesulfonic acid; In 1,2-dichloro-ethane; for 0.5h; Heating;

DOI:10.1135/cccc19961244

Reference yield: 75.0%

2,6-dibromophenol (608-33-3) + acetyl chloride (75-36-5) → 1-acetoxy-2,6-dibromobenzene (28165-72-2)

Guidance literature:

With tetrabutyl-ammonium chloride; sodium hydroxide; In dichloromethane; water; at 0 ℃; for 0.0833333h;

DOI:10.1080/00397911.2011.584007

upstream raw materials:

2,6-dibromophenol

acetic anhydride

Isopropenyl acetate

acetyl chloride

Downstream raw materials:

1-(3,5-dibromo-4-hydroxyphenyl)ethan-1-one

2,6-bis((4-(pyridin-4-yl)phenyl)ethynyl)phenyl acetate

2,6-bis((4-(pyridin-4-yl)phenyl)ethynyl)phenol

4,4'-(5-(2-(2-(2-(2,6-bis((4-(pyridin-4-yl)phenyl)ethynyl)phenoxy)ethoxy)ethoxy)ethoxy)-1,3-phenylene)dipyridine