Trimethyl(p-methylbenzyl)ammonium chloride

Base Information

• Chemical Name: Trimethyl(p-methylbenzyl)ammonium chloride
• CAS No.: 4519-36-2
• Molecular Formula: C11H18N+
• Molecular Weight: 199.724
• Hs Code.: 2923900090
• European Community (EC) Number: 224-846-7
• DSSTox Substance ID: DTXSID40884083
• NSC Number: 89748
• Mol file: 4519-36-2.mol

Synonyms:p-methylbenzyltrimethylammonium chloride;(4-methylbenzyl)-trimethylammonium chloride;trimethyl-(4-methyl-benzyl)-ammonium,chloride;Trimethyl-p-methylbenzylammoniumchlorid;Methochlorid des Dimethyl-(4-methyl-benzyl)-amins;Trimethyl-(4-methyl-benzyl)-ammonium,Chlorid;Trimethyl(p-methylbenzyl)ammonium chloride;trimethyl[(4-methylphenyl)methyl]azanium chloride;

Chemical Property of Trimethyl(p-methylbenzyl)ammonium chloride

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 0.00000
• Density: g/cm³
• LogP: -0.79480
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 199.1127773
• Heavy Atom Count: 13
• Complexity: 126

Purity/Quality:

99%, ^*data from raw suppliers

TRIMETHYL[(4-METHYLPHENYL)METHYL]AZANIUM CHLORIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C[N+](C)(C)C.[Cl-]

Technology Process of Trimethyl(p-methylbenzyl)ammonium chloride

There total 4 articles about Trimethyl(p-methylbenzyl)ammonium 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:

4-Methylbenzyl alcohol (589-18-4) → (4-methylbenzyl)-trimethylammonium chloride (4519-36-2)

Guidance literature:

Multi-step reaction with 2 steps

1: benzene; pyridine; thionyl chloride

With pyridine; thionyl chloride; benzene;

DOI:10.1021/ja01150a113

Reference yield:

para-methylphenylmagnesium bromide (4294-57-9) → (4-methylbenzyl)-trimethylammonium chloride (4519-36-2)

Guidance literature:

Multi-step reaction with 3 steps

1: paraformaldehyde; diethyl ether

2: benzene; pyridine; thionyl chloride

With pyridine; formaldehyd; thionyl chloride; diethyl ether; benzene;

DOI:10.1021/ja01150a113

Reference yield:

4-Methylbenzyl chloride (104-82-5) + trimethylamine (75-50-3) → (4-methylbenzyl)-trimethylammonium chloride (4519-36-2)

Guidance literature:

DOI:10.1021/ja01150a113

upstream raw materials:

4-Methylbenzyl chloride

trimethylamine

4-Methylbenzyl alcohol

para-methylphenylmagnesium bromide

Downstream raw materials:

[2.2]Paracyclophan

1-(but-3-en-1-yl)-4-methylbenzene

4-allyl-4-methylcyclohexa-2,5-dien-1-one

4,16-dibromo[2.2]paracyclophane

Refernces

• 1、 -. "Difluoromethyltriazolone compounds, use of the same and intermediates for the production thereof". . . Retrieved 2008/06/13.