2-Bromophenyl propargyl ether

Base Information

• Chemical Name: 2-Bromophenyl propargyl ether
• CAS No.: 38770-76-2
• Molecular Formula: C9H7BrO
• Molecular Weight: 211.058
• DSSTox Substance ID: DTXSID40450904
• Nikkaji Number: J892.448A
• Wikidata: Q82270741
• Mol file: 38770-76-2.mol

Synonyms:38770-76-2;1-Bromo-2-(prop-2-yn-1-yloxy)benzene;2-bromophenyl propargyl ether;1-bromo-2-prop-2-ynoxybenzene;1-bromo-2-prop-2-ynoxy-benzene;Benzene, 1-bromo-2-(2-propynyloxy)-;O-propargyl-2-bromophenol;(2-Bromophenyl)propargyl ether;SCHEMBL1800668;DTXSID40450904;ZCILWDWEHZCFHH-UHFFFAOYSA-N;AKOS000179028;AT23367;CS-0239776;EN300-218840

Chemical Property of 2-Bromophenyl propargyl ether

Chemical Property:

• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 209.96803
• Heavy Atom Count: 11
• Complexity: 158

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C#CCOC1=CC=CC=C1Br

Technology Process of 2-Bromophenyl propargyl ether

There total 6 articles about 2-Bromophenyl propargyl ether 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-hydroxybromobenzene (95-56-7) + propargyl bromide (106-96-7) → 1-bromo-2-(prop-2-yn-1-yloxy)benzene (38770-76-2)

Guidance literature:

With potassium carbonate; In toluene; acetonitrile; at 60 ℃; for 16h;

Reference yield: 89.0%

2-hydroxybromobenzene (95-56-7) + propargyl alcohol (107-19-7) → 1-bromo-2-(prop-2-yn-1-yloxy)benzene (38770-76-2)

Guidance literature:

With di-isopropyl azodicarboxylate; triphenylphosphine; In tetrahydrofuran; at 0 - 20 ℃; for 3h; Inert atmosphere;

DOI:10.1002/ejoc.201101777

Reference yield: 88.0%

dipropargyl ether (6921-27-3) + 2-hydroxybromobenzene (95-56-7) → 1-bromo-2-(prop-2-yn-1-yloxy)benzene (38770-76-2)

Guidance literature:

With potassium carbonate; In acetone; toluene; at 20 ℃;

DOI:10.1021/acs.orglett.9b03999

upstream raw materials:

2-hydroxybromobenzene

propargyl bromide

propargyl alcohol

O-allyl-2-bromophenol

Downstream raw materials:

7-bromo-2-methylbenzofuran

4-((2-bromophenoxy)methyl)-1-phenyl-1H-1,2,3-triazole

1-phenyl-5-(2-bromophenoxymethylene)-1,2,3-triazole

3-methyl-benzofuran