(4-Acetamidophenacyl)trimethylammonium chloride

Base Information

• Chemical Name: (4-Acetamidophenacyl)trimethylammonium chloride
• CAS No.: 52018-82-3
• Molecular Formula: C13H19 N2 O2 . Cl
• Molecular Weight: 270.759
• Hs Code.: 2924299090
• European Community (EC) Number: 257-608-6
• DSSTox Substance ID: DTXSID50885980
• Mol file: 52018-82-3.mol

Synonyms:(4-Acetamidophenacyl)trimethylammonium chloride;52018-82-3;EINECS 257-608-6;Ammonium, (p-acetamidophenacyl)trimethyl-, chloride;Benzeneethanaminium, 4-(acetylamino)-N,N,N-trimethyl-.beta.-oxo-, chloride;Benzeneethanaminium, 4-(acetylamino)-N,N,N-trimethyl-beta-oxo-, chloride;Benzeneethanaminium, 4-(acetylamino)-N,N,N-trimethyl-beta-oxo-, chloride (1:1);C13H19N2O2.Cl;SCHEMBL11590362;DTXSID50885980;Benzeneethanaminium, 4-(acetylamino)-N,N,N-trimethyl-.beta.-oxo-, chloride (1:1)

Chemical Property of (4-Acetamidophenacyl)trimethylammonium chloride

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 46.17000
• Density: g/cm³
• LogP: -1.38910
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 270.1135055
• Heavy Atom Count: 18
• Complexity: 286

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)NC1=CC=C(C=C1)C(=O)C[N+](C)(C)C.[Cl-]

Technology Process of (4-Acetamidophenacyl)trimethylammonium chloride

There total 2 articles about (4-Acetamidophenacyl)trimethylammonium 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:

trimethylamine (75-50-3) → (4-acetylamino-phenacyl)-trimethyl-ammonium; chloride (52018-82-3)

Guidance literature:

With methanol;

Reference yield:

N-[4-(chloroacetyl)phenyl]acetamide (140-49-8) + trimethylamine (75-50-3) → (4-acetylamino-phenacyl)-trimethyl-ammonium; chloride (52018-82-3)

Guidance literature:

In water; for 2h; Ambient temperature;

Reference yield:

(4-acetylamino-phenacyl)-trimethyl-ammonium; chloride (52018-82-3) → 4-(N-acetylamino)acetophenone (2719-21-3,150667-24-6)

Guidance literature:

With sodium hydroxide; sodium dithionite; at 70 ℃; for 2h;

upstream raw materials:

N-[4-(chloroacetyl)phenyl]acetamide

trimethylamine

Downstream raw materials:

4-(N-acetylamino)acetophenone

Refernces