1-Imidazolidinecarbonyl chloride, 3-(3-chlorophenyl)-2-oxo-

Base Information

• Chemical Name: 1-Imidazolidinecarbonyl chloride, 3-(3-chlorophenyl)-2-oxo-
• CAS No.: 62868-28-4
• Molecular Formula: C10H8Cl2N2O2
• Molecular Weight: 259.092
• DSSTox Substance ID: DTXSID10461683
• Nikkaji Number: J1.415.262H
• Wikidata: Q82286072

Synonyms:62868-28-4;1-Imidazolidinecarbonyl chloride, 3-(3-chlorophenyl)-2-oxo-;SCHEMBL11595078;DTXSID10461683

Chemical Property of 1-Imidazolidinecarbonyl chloride, 3-(3-chlorophenyl)-2-oxo-

Chemical Property:

• Boiling Point: 376.6±44.0 °C(Predicted)
• Density: 1.527±0.06 g/cm3(Predicted)
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 257.9962829
• Heavy Atom Count: 16
• Complexity: 311

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(C(=O)N1C2=CC(=CC=C2)Cl)C(=O)Cl

Technology Process of 1-Imidazolidinecarbonyl chloride, 3-(3-chlorophenyl)-2-oxo-

There total 4 articles about 1-Imidazolidinecarbonyl chloride, 3-(3-chlorophenyl)-2-oxo- 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: 85.5%

bis(trichloromethyl) carbonate (32315-10-9) + 1-(3-chlorophenyl)-imidazolidin-2-one (14088-98-3) → 1-chlorocarbonyl-2-oxo-3-m-chlorophenyl-imidazolidine (62868-28-4)

Guidance literature:

In tetrahydrofuran; at 55 - 60 ℃; for 2.5h;

Reference yield: 81.0%

1-(3-chlorophenyl)-imidazolidin-2-one (14088-98-3) + trichloromethyl chloroformate (503-38-8) → 1-chlorocarbonyl-2-oxo-3-m-chlorophenyl-imidazolidine (62868-28-4)

Guidance literature:

With pyridine; In tetrahydrofuran; at 50 - 55 ℃; for 2h;

DOI:10.1080/00304940009356767

Reference yield:

→ Sodium-7-{D-α-[(2-oxo-3-m-chlorophenyl-imidazolidin-1-yl)-carbonylamino]-phenylacetamido}-3-acetoxymethyl-ceph-3-em-4-carboxylate + 1-chlorocarbonyl-2-oxo-3-m-chlorophenyl-imidazolidine (62868-28-4)

Guidance literature:

upstream raw materials:

1-(3-chlorophenyl)-imidazolidin-2-one

trichloromethyl chloroformate

bis(trichloromethyl) carbonate

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