1-[2-(4-Fluorophenoxy)ethyl]piperazine

Base Information

• Chemical Name: 1-[2-(4-Fluorophenoxy)ethyl]piperazine
• CAS No.: 77602-92-7
• Molecular Formula: C12H17FN2O
• Molecular Weight: 224.278
• Hs Code.: 2933599590
• DSSTox Substance ID: DTXSID20358439
• Nikkaji Number: J1.787.506J
• Wikidata: Q82138999
• Mol file: 77602-92-7.mol

Synonyms:1-[2-(4-fluorophenoxy)ethyl]piperazine;77602-92-7;1-(2-(4-Fluorophenoxy)ethyl)piperazine;1-(2-(4-fluorophenoxy)ethyl)piperazine dihydrochloride;SCHEMBL1730763;DTXSID20358439;IHVXZESETSWDAC-UHFFFAOYSA-N;CDA60292;BBL030256;MFCD04211513;STL146850;AKOS000302992;1-[2-(4-fluorophenoxy) ethyl]piperazine;BB 0217765;CS-0116574;FT-0677465;VU0047081-1;1-[2-(4-Fluorophenoxy)ethyl]piperazine, AldrichCPR

Chemical Property of 1-[2-(4-Fluorophenoxy)ethyl]piperazine

Chemical Property:

• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 4
• Exact Mass: 224.13249133
• Heavy Atom Count: 16
• Complexity: 190

Purity/Quality:

98%min ^*data from raw suppliers

1-[2-(4-fluorophenoxy)ethyl]piperazine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1)CCOC2=CC=C(C=C2)F

Technology Process of 1-[2-(4-Fluorophenoxy)ethyl]piperazine

There total 6 articles about 1-[2-(4-Fluorophenoxy)ethyl]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: 100.0%

4-[2-(4-fluorophenoxy)ethyl]piperazine-1-carboxylic acid tert-butyl ester (947695-05-8) → 1-<2-(4-fluorophenoxy)ethyl>piperazine (77602-92-7)

Guidance literature:

4-[2-(4-fluorophenoxy)ethyl]piperazine-1-carboxylic acid tert-butyl ester; With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 2h;

With sodium hydrogencarbonate; In dichloromethane; water;

Reference yield: 73.0%

→ 1-<2-(4-fluorophenoxy)ethyl>piperazine (77602-92-7)

Guidance literature:

Reference yield: 56.0%

4-[2-(4-Fluoro-phenoxy)-ethyl]-piperazine-1-carboxylic acid ethyl ester (70931-41-8) → 1-<2-(4-fluorophenoxy)ethyl>piperazine (77602-92-7)

Guidance literature:

With potassium hydroxide; In ethanol; at 120 ℃; for 4h;

DOI:10.1135/cccc19803182

upstream raw materials:

4-[2-(4-Fluoro-phenoxy)-ethyl]-piperazine-1-carboxylic acid ethyl ester

4-[2-(4-fluorophenoxy)ethyl]piperazine-1-carboxylic acid tert-butyl ester

1-fluoro-4-methoxybenzene

4-Fluorophenol

Downstream raw materials:

thiophen-2-yl(4-(2-(4-fluorophenoxy)ethyl)piperazin-1-yl)methanone

thiophen-2-yl(4-(2-(4-fluorophenoxy)ethyl)piperazin-1-yl)methanone hydrochloride