Neopentylmagnesium chloride

Base Information

• Chemical Name: Neopentylmagnesium chloride
• CAS No.: 13132-23-5
• Molecular Formula: C5H11ClMg
• Molecular Weight: 130.9
• Hs Code.: 2931900090
• European Community (EC) Number: 803-035-7
• Mol file: 13132-23-5.mol

Synonyms:13132-23-5;Neopentylmagnesium chloride;2,2-dimethylpropylmagnesium chloride;MFCD00061550;Magnesium, chloro(2,2-dimethylpropyl)- (9CI);2,2-Dimethylpropyl Magnesium Chloride;Neopentylmagnesiumchlorid;Magnesium,chloro(2,2-dimethylpropyl)- (9CI);neopentyl magnesium chloride;SCHEMBL5238;ZPEDJLDBSQDLEI-UHFFFAOYSA-M;2, 2-Dimethylpropylmagnesium chloride;AKOS015909224;Magnesium,chloro(2,2-dimethylpropyl)-(9ci);Neopentylmagnesium chloride, 1.0M in 2-MeTHF;Neopentylmagnesium chloride, 1.0M in Diethyl Ether;2,2-Dimethylpropylmagnesium chloride, 1.0 M in 2-MeTHF;2,2-Dimethylpropylmagnesium chloride, 1M in diethyl ether;2,2-Dimethylpropylmagnesium chloride 1.0 M in Diethyl Ether

Chemical Property of Neopentylmagnesium chloride

Chemical Property:

• Vapor Pressure: 1420mmHg at 25°C
• Boiling Point: 7.2°C at 760 mmHg
• Flash Point: −26 °F
• PSA: 0.00000
• Density: 0.771 g/mL at 25 °C
• LogP: 2.68960
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 130.0399697
• Heavy Atom Count: 7
• Complexity: 29.6

Purity/Quality:

98%,99%, ^*data from raw suppliers

2,2-Dimethylpropylmagnesium chloride solution 1.0M in diethyl ether ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F+;C
• Hazard Codes: F+,C,F
• Statements: 12-14-19-22-34-67-14/15-11-40-37
• Safety Statements: 16-26-36/37/39-45-43

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)[CH2-].[Mg+2].[Cl-]

Technology Process of Neopentylmagnesium chloride

There total 2 articles about Neopentylmagnesium 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:

neopentyl chloride (753-89-9) → 2,2-dimethylpropylmagnesium chloride (13132-23-5)

Guidance literature:

With magnesium; In diethyl ether; at 20 - 34 ℃; Yield given;

Reference yield:

diethyl ether (60-29-7,927820-24-4) + neopentyl chloride (753-89-9) → 2,2-dimethylpropylmagnesium chloride (13132-23-5)

Guidance literature:

Reference yield: 90.0%

2,2-dimethylpropylmagnesium chloride (13132-23-5) + 5-Bromo-2-fluoro-benzonitrile (179897-89-3) → 5-neopentyl-2-fluoro-1-yl-benzonitrile (861857-65-0)

Guidance literature:

2,2-dimethylpropylmagnesium chloride; With zinc(II) chloride; In tetrahydrofuran; diethyl ether; at 0 ℃; for 1h;

5-Bromo-2-fluoro-benzonitrile; bis(tri-t-butylphosphine)palladium⁽⁰⁾; In tetrahydrofuran; diethyl ether; at 0 ℃; for 1h; Heating / reflux;

upstream raw materials:

neopentyl chloride

diethyl ether

Downstream raw materials:

neopentyl iodide

2,2-dimethyl-propane-1-sulfonyl chloride

3,3-dimethylbutanol

tert-Butylacetic acid

Refernces