IMIDAZOLIDINE, 2-(p-CHLOROPHENYL)-1,3-DIMETHYL-

Base Information

• Chemical Name: IMIDAZOLIDINE, 2-(p-CHLOROPHENYL)-1,3-DIMETHYL-
• CAS No.: 23281-56-3
• Molecular Formula: C11H15 Cl N2
• Molecular Weight: 210.706
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID90177851
• Nikkaji Number: J105.104K
• Wikidata: Q83048198
• Mol file: 23281-56-3.mol

Synonyms:23281-56-3;IMIDAZOLIDINE, 2-(p-CHLOROPHENYL)-1,3-DIMETHYL-;BRN 0957957;2-(p-Chlorophenyl)-1,3-dimethylimidazolidine;Imidazolidine, 2-(4-chlorophenyl)-1,3-dimethyl-;1,3-dimethyl-2-(4-chlorophenyl)imidazolidine;DTXSID90177851;WEAVUIXCKWTMNE-UHFFFAOYSA-N;LS-79029;2-(4-Chlorophenyl)-1,3-dimethylimidazolidine #

Chemical Property of IMIDAZOLIDINE, 2-(p-CHLOROPHENYL)-1,3-DIMETHYL-

Chemical Property:

• Vapor Pressure: 0.00809mmHg at 25°C
• Boiling Point: 267.6°Cat760mmHg
• PKA: 6.78±0.40(Predicted)
• Flash Point: 115.6°C
• PSA: 6.48000
• Density: 1.126g/cm³
• LogP: 2.09160
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 210.0923762
• Heavy Atom Count: 14
• Complexity: 180

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCN(C1C2=CC=C(C=C2)Cl)C

Technology Process of IMIDAZOLIDINE, 2-(p-CHLOROPHENYL)-1,3-DIMETHYL-

There total 2 articles about IMIDAZOLIDINE, 2-(p-CHLOROPHENYL)-1,3-DIMETHYL- 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: 99.0%

4-chlorobenzaldehyde (104-88-1) + N,N`-dimethylethylenediamine (110-70-3) → 1,3-dimethyl-2-(4-chlorophenyl)imidazolidine (23281-56-3)

Guidance literature:

With ammonium chloride; for 2h; Dean-Stark; Reflux; Green chemistry;

DOI:10.1039/c5gc00465a

Reference yield:

→ 1,3-dimethyl-2-(4-chlorophenyl)imidazolidine (23281-56-3)

Guidance literature:

p-Chlorbenzaldehyd, N,N'-Dimethylethylendiamin (S.2537);

DOI:10.1021/ja00425a024

Reference yield: 32.0%

methyl chloroformate (79-22-1) + 1,3-dimethyl-2-(4-chlorophenyl)imidazolidine (23281-56-3) → bis-(4,4′-formyl)benzophenone (162896-87-9) + methyl 4-formylbenzoate (1571-08-0) + 4,4',4''-triflomyltrityl alcohol

Guidance literature:

1,3-dimethyl-2-(4-chlorophenyl)imidazolidine; With naphthalene; lithium; In tetrahydrofuran; at -40 ℃; for 3h;

methyl chloroformate; In tetrahydrofuran; at -80 ℃; for 0.5h;

With sulfuric acid; In tetrahydrofuran; water; at 20 ℃; for 1h;

DOI:10.1016/j.tet.2005.01.093

upstream raw materials:

4-chlorobenzaldehyde

N,N`-dimethylethylenediamine

Downstream raw materials:

bis-(4,4′-formyl)benzophenone

methyl 4-formylbenzoate

1,3-dimethyl-2-phenylimidazolidine

4-(1-hydroxy-2,2-dimethylpropyl) benzaldehyde

Refernces

• 1、 Azzena, Ugo,Dettori, Giovanna,Pisano, Luisa,Siotto, Immacolata. "Reductive lithiation of 1,3-dimethyl-2-arylimidazolidines". . p. 3177 - 3182. Retrieved 2007/10/03.