5-Bromobiphenyl-2-yl acetate

Base Information

• Chemical Name: 5-Bromobiphenyl-2-yl acetate
• CAS No.: 57018-28-7
• Molecular Formula: C14H11BrO2
• Molecular Weight: 291.144
• NSC Number: 95732
• DSSTox Substance ID: DTXSID70294292
• Wikidata: Q82033517

Synonyms:57018-28-7;5-bromobiphenyl-2-yl acetate;NSC95732;NCIOpen2_005824;DTXSID70294292;NSC-95732

Chemical Property of 5-Bromobiphenyl-2-yl acetate

Chemical Property:

• Vapor Pressure: 7.96E-06mmHg at 25°C
• Boiling Point: 375.1°Cat760mmHg
• Flash Point: 180.7°C
• Density: 1.396g/cm³
• XLogP3: 4
• 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:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)OC1=C(C=C(C=C1)Br)C2=CC=CC=C2

Technology Process of 5-Bromobiphenyl-2-yl acetate

There total 3 articles about 5-Bromobiphenyl-2-yl 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:

2-acetoxybiphenyl (3271-80-5) → acetic acid-(5-bromo-biphenyl-2-yl ester) (57018-28-7) + acetic acid-(3,5-dibromo-biphenyl-2-yl ester) (500308-27-0)

Guidance literature:

With bromine; iron; acetic acid; at 100 ℃;

DOI:10.1021/ja01852a025

Reference yield:

5-bromo-[1,1′-biphenyl]-2-ol (16434-97-2) + acetic anhydride (108-24-7) → acetic acid-(5-bromo-biphenyl-2-yl ester) (57018-28-7)

Guidance literature:

With sodium acetate;

DOI:10.1021/ja01852a025

Reference yield:

2-acetoxybiphenyl (3271-80-5) + acetic acid (64-19-7,77671-22-8) → acetic acid-(5-bromo-biphenyl-2-yl ester) (57018-28-7)

Guidance literature:

at 100 ℃;

DOI:10.1021/ja01852a025

upstream raw materials:

2-acetoxybiphenyl

5-bromo-[1,1′-biphenyl]-2-ol

acetic anhydride

acetic acid

Downstream raw materials:

5-bromo-[1,1′-biphenyl]-2-ol

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