alpha-Phenylethyl-trimethylammonium iodide

Base Information

• Chemical Name: alpha-Phenylethyl-trimethylammonium iodide
• CAS No.: 53759-17-4
• Molecular Formula: C₁₁H₁₈N*I
• Molecular Weight: 291.175
• European Community (EC) Number: 684-396-6
• DSSTox Substance ID: DTXSID00968530
• Mol file: 53759-17-4.mol

Synonyms:alpha-Phenylethyl-trimethylammonium iodide;Trimethyl(alpha-methylbenzyl)ammonium iodide;alpha-Methylphenmethyl-trimethylammonium iodide;AMMONIUM, TRIMETHYL(alpha-METHYLBENZYL)-, IODIDE;53759-17-4;SCHEMBL10961531;DTXSID00968530;AKOS024331919;alpha-methylbenzyl trimethylammonium iodide;LS-19144;N,N,N-Trimethyl-1-phenylethan-1-aminium iodide;Benzenemethanaminium, N,N,N,.alpha.-tetramethyl-, iodide

Chemical Property of alpha-Phenylethyl-trimethylammonium iodide

Chemical Property:

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 291.04840
• Heavy Atom Count: 13
• Complexity: 128

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of alpha-Phenylethyl-trimethylammonium iodide

There total 8 articles about alpha-Phenylethyl-trimethylammonium 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: 95.0%

(S)-N,N-dimethyl-1-phenylethylamine (19342-01-9) + methyl iodide (74-88-4) → (R)-α-methylbenzyl trimethyl ammonium iodide (17279-33-3,53759-17-4,54712-34-4)

Guidance literature:

In chloroform; for 5h;

DOI:10.1016/j.jorganchem.2003.12.012

Reference yield:

dimethyl(1-phenylethyl)amine (2449-49-2,7398-61-0,17279-31-1,19342-01-9) + methyl iodide (74-88-4) → α-methylbenzyl trimethyl ammonium iodide (53759-17-4,17279-33-3,54712-34-4)

Guidance literature:

DOI:10.1021/ja01634a018

Reference yield:

methyl iodide (74-88-4) → (R)-α-methylbenzyl trimethyl ammonium iodide (17279-33-3,53759-17-4,54712-34-4)

Guidance literature:

With diethyl ether;

DOI:10.1021/ja01169a077

upstream raw materials:

(1-iodoethyl)benzene

trimethylamine

dimethyl(1-phenylethyl)amine

methyl iodide

Downstream raw materials:

2-(dimethylaminomethylphenyl)ethylbenzene

2,3-diphenylbutane

ethylbenzene

1-Phenylethanol