1-Nitroso-4-phenylpiperazine

Base Information

• Chemical Name: 1-Nitroso-4-phenylpiperazine
• CAS No.: 14340-33-1
• Molecular Formula: C10H13 N3 O
• Molecular Weight: 191.233
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID30162408
• Nikkaji Number: J1.890.106D
• Wikidata: Q83031081
• Mol file: 14340-33-1.mol

Synonyms:1-Nitroso-4-phenylpiperazine;14340-33-1;Piperazine, 1-nitroso-4-phenyl-;Piperazine, 1-nitroso-4-phenyl- (8CI,9CI);SCHEMBL18650406;DTXSID30162408;AKOS030254812;EN300-8614254

Chemical Property of 1-Nitroso-4-phenylpiperazine

Chemical Property:

• Vapor Pressure: 7.73E-06mmHg at 25°C
• Boiling Point: 375.5°Cat760mmHg
• Flash Point: 180.9°C
• PSA: 35.91000
• Density: 1.19g/cm³
• LogP: 1.49290
• Storage Temp.: Refrigerator
• Solubility.: Chloroform (Slightly), Ethyl Acetate (Slightly)
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 191.105862047
• Heavy Atom Count: 14
• Complexity: 184

Purity/Quality:

99% ^*data from raw suppliers

1-Nitroso-4-phenylpiperazine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN(CCN1C2=CC=CC=C2)N=O
• Uses: Metabolite of N-Phenylpiperazine (P336040) found in wastewater treatment facilities.

Technology Process of 1-Nitroso-4-phenylpiperazine

There total 2 articles about 1-Nitroso-4-phenylpiperazine 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: 90.0%

4-phenyl-1-piperazine (92-54-6) → 1-nitroso-4-phenylpiperazine (14340-33-1)

Guidance literature:

With bismuth(III) chloride; sodium nitrite; In dichloromethane; at 20 ℃; for 0.5h; chemoselective reaction;

DOI:10.1080/00397910802413881

Reference yield:

→ 1-nitroso-4-phenylpiperazine (14340-33-1)

Guidance literature:

Entspr. Piperazin, Nitrosierung;

Reference yield: 91.0%

1-nitroso-4-phenylpiperazine (14340-33-1) → 4-amino-1-phenylpiperazine (14340-32-0)

Guidance literature:

With carbon dioxide; water; ammonium chloride; zinc; at 35 ℃; for 1.5h; under 1500.15 Torr; Autoclave; Green chemistry;

DOI:10.1007/s10593-018-2349-0

upstream raw materials:

4-phenyl-1-piperazine

Downstream raw materials:

4-amino-1-phenylpiperazine

1-Amino-1-methyl-4-phenylpiperazinium Iodide