2,2'-Bipyridine, 6-(bromomethyl)-6'-methyl-

Base Information

• Chemical Name: 2,2'-Bipyridine, 6-(bromomethyl)-6'-methyl-
• CAS No.: 96517-98-5
• Molecular Formula: C12H11BrN2
• Molecular Weight: 263.13300
• DSSTox Substance ID: DTXSID00466985
• Nikkaji Number: J640.915F
• Wikidata: Q82293707
• Mol file: 96517-98-5.mol

Synonyms:2,2'-Bipyridine, 6-(bromomethyl)-6'-methyl-;96517-98-5;2-(bromomethyl)-6-(6-methylpyridin-2-yl)pyridine;SCHEMBL8908397;DTXSID00466985;6-bromomethyl-6'-methyl-2,2'-bipyridine;EN300-10009585;2-[6-(bromomethyl)pyridin-2-yl]-6-methylpyridine

Chemical Property of 2,2'-Bipyridine, 6-(bromomethyl)-6'-methyl-

Chemical Property:

• PSA: 25.78000
• LogP: 3.34690
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 262.01056
• Heavy Atom Count: 15
• Complexity: 198

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=NC(=CC=C1)C2=CC=CC(=N2)CBr

Technology Process of 2,2'-Bipyridine, 6-(bromomethyl)-6'-methyl-

There total 5 articles about 2,2'-Bipyridine, 6-(bromomethyl)-6'-methyl- 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: 59.0%

6,6'-dimethyl-2,2'-bipyridine (4411-80-7) → 6-(bromomethyl)-6'-methyl-2,2'-bipyridine (96517-98-5) + 6,6'-bis-(bromomethyl)-2,2'-bipyridine (96517-97-4) + 6,6'-bis(dibromomethyl)-2,2'-bipyridine

Guidance literature:

With N-Bromosuccinimide; Perbenzoic acid; In tetrachloromethane; for 2h; Heating;

DOI:10.1002/hlca.19840670833

Reference yield: 56.0%

6,6'-dimethyl-2,2'-bipyridine (4411-80-7) → 6-(bromomethyl)-6'-methyl-2,2'-bipyridine (96517-98-5) + 6,6'-bis-(bromomethyl)-2,2'-bipyridine (96517-97-4)

Guidance literature:

With N-Bromosuccinimide; dibenzoyl peroxide; In tetrachloromethane; for 6h; Heating;

DOI:10.1039/DT9950001511

Reference yield: 15.0%

6,6'-dimethyl-2,2'-bipyridine (4411-80-7) → C12H10Br2N2 + C12H9Br3N2 + 6-(bromomethyl)-6'-methyl-2,2'-bipyridine (96517-98-5) + 6,6'-bis-(bromomethyl)-2,2'-bipyridine (96517-97-4)

Guidance literature:

With 2,2'-azobis(isobutyronitrile); 1,3,4,6-Tetrabromo-3α,6α-diphenylglycoluril; In tetrachloromethane; at 81 ℃; for 1h; Inert atmosphere;

DOI:10.1002/hc.21314

upstream raw materials:

6,6'-dimethyl-2,2'-bipyridine

2-Amino-6-methylpyridine

2-bromo-6-methylpyridine

Downstream raw materials:

6,6'-bis-(bromomethyl)-2,2'-bipyridine

2-(Boc-amino)ethyl-4-[6-methyleneoxy-6'-methyl-2,2'-bipyridyl]-benzene

methyl 2-{4-[(6'-methyl-2,2'-bipyridin-6-yl)methoxy]phenyl}acetate

C₂₀H₁₈N₂O₃