1-(4,6-Dimethyl-2-pyrimidyl)piperazine

Base Information

• Chemical Name: 1-(4,6-Dimethyl-2-pyrimidyl)piperazine
• CAS No.: 22746-09-4
• Molecular Formula: C10H16N4
• Molecular Weight: 192.264
• Hs Code.: 2933599590
• European Community (EC) Number: 674-984-0
• DSSTox Substance ID: DTXSID90374429
• Wikidata: Q82163021
• Mol file: 22746-09-4.mol

Synonyms:22746-09-4;1-(4,6-Dimethyl-2-pyrimidyl)piperazine;4,6-dimethyl-2-(piperazin-1-yl)pyrimidine;4,6-Dimethyl-2-piperazin-1-yl-pyrimidine;4,6-dimethyl-2-piperazin-1-ylpyrimidine;1-(4,6-Dimethyl-2-pyrimidinyl)piperazine;1-(4,6-dimethylpyrimidin-2-yl)piperazine;SCHEMBL1515373;DTXSID90374429;QLTXFTSBONWMPM-UHFFFAOYSA-N;HMS1700B05;MFCD00885959;STK663215;AKOS000268805;FS-1664;4,6-dimethyl-2-(1-piperazinyl)pyrimidine;BB 0219225;FT-0692382;EN300-131671;1-(4,6-dimethylpyrimidin-2-yl)piperazine, AldrichCPR

Chemical Property of 1-(4,6-Dimethyl-2-pyrimidyl)piperazine

Chemical Property:

• Melting Point: 115-118
• Boiling Point: 115-118°C 1mm
• PSA: 41.05000
• LogP: 0.89680
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 192.137496527
• Heavy Atom Count: 14
• Complexity: 169

Purity/Quality:

97% ^*data from raw suppliers

4,6-Dimethyl-2-(piperazin-1-yl)pyrimidine 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 36/37/38-22
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=NC(=N1)N2CCNCC2)C

Technology Process of 1-(4,6-Dimethyl-2-pyrimidyl)piperazine

There total 10 articles about 1-(4,6-Dimethyl-2-pyrimidyl)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: 96.0%

piperazine (110-85-0) + 2-chloro-4,6-dimethylpyrimidine (4472-44-0) → 4,6-dimethyl-2-(piperazin-1-yl)pyrimidine (22746-09-4)

Guidance literature:

With potassium carbonate; In tetrahydrofuran; water; at 20 ℃; for 24h;

DOI:10.3390/molecules24203661

Reference yield: 65.0%

piperazine (110-85-0) + 4,6-dimethyl-2-methylsulfonylpyrimidine (35144-22-0) → 4,6-dimethyl-2-(piperazin-1-yl)pyrimidine (22746-09-4)

Guidance literature:

In ethanol; 1.) ice bath, 2.) room temperature;

DOI:10.1248/cpb.39.2288

Reference yield: 58.0%

→ 4,6-dimethyl-2-(piperazin-1-yl)pyrimidine (22746-09-4)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 100 ℃; for 10h;

upstream raw materials:

piperazine

4,6-dimethyl-2-methylsulfonylpyrimidine

2-chloro-4,6-dimethylpyrimidine

4,6-dimethyl-2-methylsulfanyl-pyrimidine

Downstream raw materials:

C₂₁H₂₂ClF₃N₈S

C₂₁H₂₂F₄N₈S

C₂₂H₂₅F₃N₈OS

C₂₃H₂₇F₃N₈S