Piperazine, 1-(2-chloroethyl)-4-(2-chlorophenyl)-

Base Information

• Chemical Name: Piperazine, 1-(2-chloroethyl)-4-(2-chlorophenyl)-
• CAS No.: 63377-89-9
• Molecular Formula: C12H16Cl2N2
• Molecular Weight: 259.17500
• DSSTox Substance ID: DTXSID20435395
• Wikidata: Q82250293
• Mol file: 63377-89-9.mol

Synonyms:63377-89-9;Piperazine, 1-(2-chloroethyl)-4-(2-chlorophenyl)-;SCHEMBL9646379;DTXSID20435395;AKOS010540114

Chemical Property of Piperazine, 1-(2-chloroethyl)-4-(2-chlorophenyl)-

Chemical Property:

• Boiling Point: 361.3±42.0 °C(Predicted)
• PSA: 6.48000
• Density: 1.212±0.06 g/cm3(Predicted)
• LogP: 2.70370
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 258.0690539
• Heavy Atom Count: 16
• Complexity: 205

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1CCCl)C2=CC=CC=C2Cl

Technology Process of Piperazine, 1-(2-chloroethyl)-4-(2-chlorophenyl)-

There total 2 articles about Piperazine, 1-(2-chloroethyl)-4-(2-chlorophenyl)- 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:

N-(o-Chlorophenyl)piperazine (39512-50-0) + 1-Bromo-2-chloroethane (107-04-0) → 1-(2-chlorophenyl)-4-(2-chloroethyl)-piperazine (63377-89-9)

Guidance literature:

With toluene-4-sulfonic acid; In 5,5-dimethyl-1,3-cyclohexadiene; at 140 - 145 ℃; for 20h;

Reference yield:

N-(o-Chlorophenyl)piperazine (39512-50-0) + 1-Bromo-2-chloroethane (107-04-0) → 1-(2-chlorophenyl)-4-(2-chloroethyl)-piperazine (63377-89-9) + C22H28Cl2N4

Guidance literature:

In toluene; Heating;

DOI:10.1016/0223-5234(96)88212-2

Reference yield: 60.0%

6-(benzimidazol-1-yl)pyridazin-3(2H)-one (109890-26-8) + 1-(2-chlorophenyl)-4-(2-chloroethyl)-piperazine (63377-89-9) → 6-benzoimidazol-1-yl-2-{2-[4-(2-chloro-phenyl)-piperazin-1-yl]-ethyl}-2H-pyridazin-3-one

Guidance literature:

With potassium carbonate; In acetone; Heating;

DOI:10.1021/jm011077g

upstream raw materials:

N-(o-Chlorophenyl)piperazine

1-Bromo-2-chloroethane

Downstream raw materials:

7-[2-[4-(2-chlorophenyl)piperazinyl]ethyl]-1,3-dimethylxanthine hydrogen chloride