1,1'-[(2E)-2-[(2,6-Dichlorophenyl)imino]-4-(hydroxymethyl)imidazolidine-1,3-diyl]di(ethan-1-one)

Base Information

• Chemical Name: 1,1'-[(2E)-2-[(2,6-Dichlorophenyl)imino]-4-(hydroxymethyl)imidazolidine-1,3-diyl]di(ethan-1-one)
• CAS No.: 109988-70-7
• Molecular Formula: C14H15Cl2N3O3
• Molecular Weight: 344.19300
• DSSTox Substance ID: DTXSID00546554
• Mol file: 109988-70-7.mol

Synonyms:109988-70-7;DTXSID00546554;1,1'-[(2E)-2-[(2,6-Dichlorophenyl)imino]-4-(hydroxymethyl)imidazolidine-1,3-diyl]di(ethan-1-one)

Chemical Property of 1,1'-[(2E)-2-[(2,6-Dichlorophenyl)imino]-4-(hydroxymethyl)imidazolidine-1,3-diyl]di(ethan-1-one)

Chemical Property:

• Boiling Point: 498.4±55.0 °C(Predicted)
• PSA: 73.21000
• Density: 1.45±0.1 g/cm3(Predicted)
• LogP: 1.92820
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 343.0490467
• Heavy Atom Count: 22
• Complexity: 476

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N1CC(N(C1=NC2=C(C=CC=C2Cl)Cl)C(=O)C)CO

Technology Process of 1,1'-[(2E)-2-[(2,6-Dichlorophenyl)imino]-4-(hydroxymethyl)imidazolidine-1,3-diyl]di(ethan-1-one)

There total 1 articles about 1,1'-[(2E)-2-[(2,6-Dichlorophenyl)imino]-4-(hydroxymethyl)imidazolidine-1,3-diyl]di(ethan-1-one) 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: 84.0%

Acetic acid 1,3-diacetyl-2-[(Z)-2,6-dichloro-phenylimino]-imidazolidin-4-ylmethyl ester (109988-68-3) → 1-{3-Acetyl-2-[(Z)-2,6-dichloro-phenylimino]-5-hydroxymethyl-imidazolidin-1-yl}-ethanone (109988-70-7)

Guidance literature:

With sodium tetrahydroborate; lithium chloride; In diethylene glycol dimethyl ether; for 18h; Ambient temperature;

DOI:10.1016/S0040-4039(00)85312-5

Reference yield:

1-{3-Acetyl-2-[(Z)-2,6-dichloro-phenylimino]-5-hydroxymethyl-imidazolidin-1-yl}-ethanone (109988-70-7) → Acetic acid 1-acetyl-2-[(E)-2,6-dichloro-phenylimino]-imidazolidin-4-ylmethyl ester (114143-67-8)

Guidance literature:

With sodium hydride; In N,N-dimethyl-formamide;

DOI:10.1016/S0040-4039(00)96886-2

upstream raw materials:

Acetic acid 1,3-diacetyl-2-[(Z)-2,6-dichloro-phenylimino]-imidazolidin-4-ylmethyl ester

Downstream raw materials:

Acetic acid 1-acetyl-2-[(E)-2,6-dichloro-phenylimino]-imidazolidin-4-ylmethyl ester