3-Chlorobenzylmagnesium chloride

Base Information

• Chemical Name: 3-Chlorobenzylmagnesium chloride
• CAS No.: 29874-01-9
• Molecular Formula: C7H6Cl2Mg
• Molecular Weight: 185.336
• DSSTox Substance ID: DTXSID40517506
• Mol file: 29874-01-9.mol

Synonyms:3-Chlorobenzylmagnesium chloride;29874-01-9;magnesium;1-chloro-3-methanidylbenzene;chloride;MFCD01319894;SCHEMBL1004527;3-Chlorobenzylmagnesium chloride 0.25 M in Diethyl Ether;DTXSID40517506;FXQFOXTUJOAWNN-UHFFFAOYSA-M;AKOS016017752;3-Chlorobenzylmagnesium chloride, 0.50 M in Ether;3-Chlorobenzylmagnesium chloride, 0.50 M in 2-MeTHF;Magnesium chloride (3-chlorophenyl)methanide (1/1/1)

Chemical Property of 3-Chlorobenzylmagnesium chloride

Chemical Property:

• PSA: 0.00000
• LogP: 3.34520
• Sensitive.: Air & Moisture Sensitive
• Water Solubility.: It reacts with water.
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 183.9696973
• Heavy Atom Count: 10
• Complexity: 78

Purity/Quality:

97% ^*data from raw suppliers

3-Chlorobenzylmagnesiumchloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [CH2-]C1=CC(=CC=C1)Cl.[Mg+2].[Cl-]
• Uses: 3-Chlorobenzylmagnesium chloride is used as pharmaceutical intermediate.

Technology Process of 3-Chlorobenzylmagnesium chloride

There total 1 articles about 3-Chlorobenzylmagnesium chloride 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%

→ 3-chlorobenzylmagnesium chloride (29874-01-9)

Guidance literature:

Reference yield: 94.0%

N-methoxy-N-methyl-1-triisopropylsilanyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide (1385020-99-4) + 3-chlorobenzylmagnesium chloride (29874-01-9) → 2-(3-chlorophenyl)-1-(1-triisopropylsilanyl-1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone (1385021-00-0)

Guidance literature:

N-methoxy-N-methyl-1-triisopropylsilanyl-1H-pyrrolo[2,3-b]pyridine-3-carboxamide; 3-chlorobenzylmagnesium chloride; In tetrahydrofuran; at 0 - 20 ℃;

With ammonium chloride; In tetrahydrofuran;

Reference yield: 92.0%

3-chlorobenzylmagnesium chloride (29874-01-9) + (-)-menthyl p-toluenesulfinate (1517-82-4) → 3-chlorobenzyl p-tolyl sulfoxide

Guidance literature:

In diethyl ether;

DOI:10.1246/bcsj.56.266

Downstream raw materials:

2-[2-(3-Chloro-phenyl)-1-hydroxy-ethyl]-phenol

4-[4-(3-chlorobenzyl)-4-hydroxy-piperidin-1-yl]-benzoic acid ethyl ester

2,2-dimethyl-propionic acid 2-[4-(3-chloro-benzyl)-2-oxo-3,4-dihydro-2H-pyridin-1-yl]-4,5-bis-(2,2-dimethyl-propionyloxy)-6-(2,2-dimethyl-propionyloxymethyl)-tetrahydro-pyran-3-yl ester

4-[4-(3-chlorobenzyl)-4-methoxy-piperidin-1-yl]-benzoic acid ethyl ester

Refernces