CID 15977722

Base Information

• Chemical Name: CID 15977722
• CAS No.: 688-98-2
• Molecular Formula: C5H11BrMg
• Molecular Weight: 175.351
• DSSTox Substance ID: DTXSID70473060
• Mol file: 688-98-2.mol

Synonyms:Magnesium, bromo(2-methylbutyl)-;DTXSID70473060

Chemical Property of CID 15977722

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 173.98945
• Heavy Atom Count: 7
• Complexity: 16

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)[CH2-].[Mg+2].[Br-]

Technology Process of CID 15977722

There total 2 articles about CID 15977722 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:

1-bromo-2-methyl-butane (10422-35-2,99032-67-4,534-00-9,5973-11-5) → 2-methylbutylmagnesium bromide (688-98-2)

Guidance literature:

With magnesium; In diethyl ether;

DOI:10.1021/ja00957a022

Reference yield:

1-bromo-2-methyl-butane (10422-35-2,99032-67-4,534-00-9,5973-11-5) + magnesium (7439-95-4) → 2-methylbutylmagnesium bromide (688-98-2)

Guidance literature:

iodine; In tetrahydrofuran; at 70 ℃; for 0.5h;

Reference yield: 58.0%

2-methylthio-4-methyl-5-(2,4,6-trifluorophenyl)-6-chloro-pyrimidine + 2-methylbutylmagnesium bromide (688-98-2) → 2-methylthio-4-methyl-5-(2,4,6-trifluorophenyl)-6-(2-methylbutyl)-pyrimidine

Guidance literature:

2-methylthio-4-methyl-5-(2,4,6-trifluorophenyl)-6-chloro-pyrimidine; 2-methylbutylmagnesium bromide; (1,1'-bis(diphenylphosphino)ferrocene)palladium(II) dichloride; In tetrahydrofuran; toluene;

With water; ammonium chloride; In tetrahydrofuran; toluene;

upstream raw materials:

1-bromo-2-methyl-butane

magnesium

Downstream raw materials:

4-methylhexan-1-ol

tetraphenylethane-1,2-diol

3-methyl-valeric acid anilide

3,5-dimethyl-3-heptanol

Refernces

• 1、 -. "TRIAZOLOPYRIMIDINES, METHODS FOR THE PRODUCTION THEREOF, USE THEREOF FOR CONTROLLING HARMFUL FUNGI, AND SUBSTANCES CONTAINING SAID TRIAZOLOPYRIMIDINES". Page/Page column 57-58. . Retrieved 2008/06/13.