2,6-Dibromo-4-ethylphenol

Base Information

• Chemical Name: 2,6-Dibromo-4-ethylphenol
• CAS No.: 57018-12-9
• Molecular Formula: C8H8Br2O
• Molecular Weight: 279.959
• European Community (EC) Number: 260-516-9
• DSSTox Substance ID: DTXSID70205626
• Nikkaji Number: J349.062I
• Wikidata: Q83079235
• Mol file: 57018-12-9.mol

Synonyms:2,6-Dibromo-4-ethylphenol;57018-12-9;EINECS 260-516-9;SCHEMBL1250655;DTXSID70205626

Chemical Property of 2,6-Dibromo-4-ethylphenol

Chemical Property:

• Vapor Pressure: 0.00565mmHg at 25°C
• Refractive Index: 1.61
• Boiling Point: 265.2 °C at 760 mmHg
• Flash Point: 114.2 °C
• PSA: 20.23000
• Density: 1.829g/cm³
• LogP: 3.47960
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 279.89214
• Heavy Atom Count: 11
• Complexity: 117

Purity/Quality:

98%Min ^*data from raw suppliers

2,6-dibromo-4-ethylphenol >96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC1=CC(=C(C(=C1)Br)O)Br

Technology Process of 2,6-Dibromo-4-ethylphenol

There total 3 articles about 2,6-Dibromo-4-ethylphenol 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: 99.0%

4-Ethylphenol (123-07-9) → 2,6-dibromo-4-ethylphenol (57018-12-9)

Guidance literature:

With bromine; In dichloromethane; at 0 - 20 ℃;

DOI:10.1039/b903530c

Reference yield: 53.0%

4-ethylphenylboronic acid (63139-21-9) → 2,6-dibromo-4-ethylphenol (57018-12-9)

Guidance literature:

With water; hydrogen bromide; dihydrogen peroxide; In ethanol; at 20 ℃; for 0.0166667h; Green chemistry;

DOI:10.1039/d0ra08580d

Reference yield:

2-bromo-4-ethylphenol (64080-15-5) → 2,6-dibromo-4-ethylphenol (57018-12-9)

Guidance literature:

With bromine; acetic acid; Behandeln unter Kuehlung;

DOI:10.1039/jr9430000525

upstream raw materials:

2-bromo-4-ethylphenol

4-Ethylphenol

4-ethylphenylboronic acid

Downstream raw materials:

4-ethyl-3,5-dibromo-phenol

2,6-Dibrom-4-aethyl-4-methoxy-cyclohexa-2,5-dienon

4-Ethyl-2,6-dibrom-4-trichlormethyl-cyclohexa-2,5-dien-1-on

2,6-Dibrom-4-aethyl-4-hydroxycyclohexa-2,5-dienon

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