4-Bromo-N,N,N-trimethylanilinium iodide

Base Information

• Chemical Name: 4-Bromo-N,N,N-trimethylanilinium iodide
• CAS No.: 33046-25-2
• Molecular Formula: C9H13BrN.I
• Molecular Weight: 342.017
• DSSTox Substance ID: DTXSID20548737
• Mol file: 33046-25-2.mol

Synonyms:33046-25-2;4-Bromo-N,N,N-trimethylanilinium iodide;DTXSID20548737

Chemical Property of 4-Bromo-N,N,N-trimethylanilinium iodide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 340.92761
• Heavy Atom Count: 12
• Complexity: 120

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+](C)(C)C1=CC=C(C=C1)Br.[I-]

Technology Process of 4-Bromo-N,N,N-trimethylanilinium iodide

There total 13 articles about 4-Bromo-N,N,N-trimethylanilinium iodide 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: 98.0%

N-(p-bromophenyl)triphenylarsine imide (110788-31-3) + methyl iodide (74-88-4) → 4-bromo-N,N,N-trimethylbenzenaminium iodide (33046-25-2) + methyltriphenylarsonium triiodide

Guidance literature:

In benzene; for 3h; Heating;

Reference yield: 88.0%

4-bromo-N,N-dimethylaniline (586-77-6) + methyl iodide (74-88-4) → 4-bromo-N,N,N-trimethylbenzenaminium iodide (33046-25-2)

Guidance literature:

In acetone; at 70 ℃; Inert atmosphere;

DOI:10.1016/j.ica.2020.119654

Reference yield: 50.0%

4-bromo-aniline (106-40-1) + methyl iodide (74-88-4) → 4-bromo-N,N,N-trimethylbenzenaminium iodide (33046-25-2)

Guidance literature:

With potassium carbonate; In acetone; at 20 ℃; for 72h;

DOI:10.1002/anie.201909865

upstream raw materials:

4-bromo-aniline

methyl iodide

4-bromo-N,N-dimethylaniline

4-Bromo-N,N-dimethylaniline N-oxide

Downstream raw materials:

1-(tert-butyl)-4-methoxybenzene

4-bromo-N,N-dimethylaniline

methyl iodide

benzene-1,4-diboronic acid bispinacol ester

Refernces

• 1、 La Manna, Pellegrino,De Rosa, Margherita,Talotta, Carmen,Rescifina, Antonio,Floresta, Giuseppe,Soriente, Annunziata,Gaeta, Carmine,Neri, Placido. "Synergic Interplay Between Halogen Bonding and Hydrogen Bonding in the Activation of a Neutral Substrate in a Nanoconfined Space". supporting information. p. 811 - 818. Retrieved 2019/12/11.
• 2、 Gavrilov, V. I.,Khusnutdinova, F. M.. "? CONSTANTS OF SOME ARSENIC-CONTAINING GROUPS". . p. 295 - 297. Retrieved 2007/10/02.