4-(N-(3-Chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium

Base Information

• Chemical Name: 4-(N-(3-Chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium
• CAS No.: 13681-36-2
• Molecular Formula: C14H20Cl2N2O2
• Molecular Weight: 319.2268
• Mol file: 13681-36-2.mol

Synonyms:4-(N-(3-chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium;4-(N-(3-chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium iodide;4-(N-(3-chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium, chloride(E)-isomer;4-(N-(3-chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium, chloride(Z)-isomer;4-(N-(3-chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium, iodide(E)-isomer;4-(N-(3-chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium, iodide(Z)-isomer

Chemical Property of 4-(N-(3-Chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 318.0901833
• Heavy Atom Count: 20
• Complexity: 313

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-(N-(3-Chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium

There total 2 articles about 4-(N-(3-Chlorophenyl)carbamoyloxy)-2-butenyltrimethylammonium 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:

m-chlorophenyl isocyanate (2909-38-8) → <4--buten-(2)-yl>-trimethyl-ammoniumhydroxyd (13681-36-2)

Guidance literature:

Multi-step reaction with 2 steps

1: benzene

2: benzene

In benzene;

DOI:10.1021/jo01049a527

Reference yield:

4-Chlor-buten-(2)-yl- (92546-32-2) + trimethylamine (75-50-3) → <4--buten-(2)-yl>-trimethyl-ammoniumhydroxyd (13681-36-2)

Guidance literature:

In benzene;

DOI:10.1021/jo01049a527

upstream raw materials:

4-Chlor-buten-(2)-yl-

trimethylamine

m-chlorophenyl isocyanate