Magnesium bromide 3-[(oxan-2-yl)oxy]benzen-1-ide (1/1/1)

Base Information

• Chemical Name: Magnesium bromide 3-[(oxan-2-yl)oxy]benzen-1-ide (1/1/1)
• CAS No.: 142402-62-8
• Molecular Formula: C11H13BrMgO2
• Molecular Weight: 281.432
• DSSTox Substance ID: DTXSID80518335
• Mol file: 142402-62-8.mol

Synonyms:Magnesium bromide 3-[(oxan-2-yl)oxy]benzen-1-ide (1/1/1);DTXSID80518335

Chemical Property of Magnesium bromide 3-[(oxan-2-yl)oxy]benzen-1-ide (1/1/1)

Chemical Property:

• PSA: 18.46000
• LogP: 3.23780
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 279.99493
• Heavy Atom Count: 15
• Complexity: 251

Purity/Quality:

96% ^*data from raw suppliers

3-(2-Tetrahydro-2H-pyranoxy)phenylmagnesiumbromide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCOC(C1)OC2=CC=C[C-]=C2.[Mg+2].[Br-]

Technology Process of Magnesium bromide 3-[(oxan-2-yl)oxy]benzen-1-ide (1/1/1)

There total 1 articles about Magnesium bromide 3-[(oxan-2-yl)oxy]benzen-1-ide (1/1/1) 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:

3-(tetrahydropyran-2-yloxy)phenyl bromide (57999-49-2) + magnesium (7439-95-4) → (3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)magnesium bromide (142402-62-8)

Guidance literature:

In tetrahydrofuran; for 0.05h; Thermodynamic data; Reflux;

DOI:10.1021/op9901801

Reference yield: 99.0%

methyl methoxyacetate (6290-49-9) + (3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)magnesium bromide (142402-62-8) → 2-methoxy-1-(3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)-ethanone

Guidance literature:

methyl methoxyacetate; (3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)magnesium bromide; In tetrahydrofuran; at -78 ℃; for 1h;

In tetrahydrofuran; at -78 - 20 ℃; for 3h;

DOI:10.1021/acs.jmedchem.0c00843

Reference yield: 99.0%

tert-butyl (2S)-2-(4-(methoxy(methyl)carbamoyl)-1,3-thiazol-2-yl)pyrrolidine-1-carboxylate (1005342-77-7) + (3-((tetrahydro-2H-pyran-2-yl)oxy)phenyl)magnesium bromide (142402-62-8) → tert-butyl (2S)-2-(4-(3-(tetrahydro-2H-pyran-2-yloxy)benzoyl)-1,3-thiazol-2-yl)pyrrolidine-1-carboxylate

Guidance literature:

In tetrahydrofuran; at -55 - -10 ℃; for 1.33333h; Inert atmosphere;

DOI:10.1021/acs.jmedchem.7b00168

upstream raw materials:

3-(tetrahydropyran-2-yloxy)phenyl bromide

magnesium

Downstream raw materials:

3-fluoro-4-((5R)-7-hydroxy-7-(3-(tetrahydro-2H-pyran-2-yloxy)phenyl)-6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-5-yl)benzonitrile

1-[4-(2-Dimethylamino-ethoxy)-phenyl]-2-phenyl-1-[3-(tetrahydro-pyran-2-yloxy)-phenyl]-butan-1-ol