1-[3-(4-Chlorophenoxy)propyl]piperazine

Base Information

• Chemical Name: 1-[3-(4-Chlorophenoxy)propyl]piperazine
• CAS No.: 93043-45-9
• Molecular Formula: C13H19ClN2O
• Molecular Weight: 254.75600
• DSSTox Substance ID: DTXSID10529873
• Wikidata: Q82400618

Synonyms:93043-45-9;1-[3-(4-Chlorophenoxy)propyl]piperazine;SCHEMBL9428389;DTXSID10529873;AKOS000343369

Chemical Property of 1-[3-(4-Chlorophenoxy)propyl]piperazine

Chemical Property:

• Boiling Point: 170-174 °C(Press: 0.4 Torr)
• PSA: 24.50000
• Density: 1.117±0.06 g/cm3(Predicted)
• LogP: 2.28080
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 254.1185909
• Heavy Atom Count: 17
• Complexity: 202

Purity/Quality:

1-[3-(4-CHLOROPHENOXY)PROPYL]-PIPERAZINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1)CCCOC2=CC=C(C=C2)Cl

Technology Process of 1-[3-(4-Chlorophenoxy)propyl]piperazine

There total 1 articles about 1-[3-(4-Chlorophenoxy)propyl]piperazine 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: 67.0%

piperazine (110-85-0) + 1-(3-bromopropoxy)-4-chlorobenzene (27983-04-6) → 1-(3-(4-chlorophenoxy)propyl)piperazine (93043-45-9)

Guidance literature:

In toluene; at 85 ℃; for 2h;

DOI:10.1071/CH09345

Reference yield: 47.0%

1-(3-(4-chlorophenoxy)propyl)piperazine (93043-45-9) + 8-chloro-5,10-dihydro-11H-dibenzo[b,e][1,4]diazepin-11-one (50892-62-1) → 8-chloro-11-(4-(3-(4-chlorophenoxy)propyl)piperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine (1219027-39-0)

Guidance literature:

With titanium tetrachloride; In methoxybenzene; toluene; for 4h; Inert atmosphere; Reflux;

DOI:10.1071/CH09345

Reference yield:

1-[2-(2,4-difluorophenyl)-2,3-epoxypropyl]-1H-1,2,4-triazole methanesulfonic acid + 1-(3-(4-chlorophenoxy)propyl)piperazine (93043-45-9) → 3-(4-(3-(4-chlorophenoxy)propyl)piperazin-1-yl)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)propan-2-ol (1146681-49-3)

Guidance literature:

With triethylamine; In ethanol; for 9h; Reflux;

DOI:10.1016/j.ejmech.2009.05.018

upstream raw materials:

piperazine

1-(3-bromopropoxy)-4-chlorobenzene

Downstream raw materials:

3-(4-(3-(4-chlorophenoxy)propyl)piperazin-1-yl)-2-(2,4-difluorophenyl)-1-(1H-1,2,4-triazol-1-yl)propan-2-ol

8-chloro-11-(4-(3-(4-chlorophenoxy)propyl)piperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine

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