4-N-phenylpyrimidine-2,4,6-triamine

Base Information

• Chemical Name: 4-N-phenylpyrimidine-2,4,6-triamine
• CAS No.: 17419-08-8
• Molecular Formula: C₁₀H₁₁N₅
• Molecular Weight: 201.231
• NSC Number: 52862
• DSSTox Substance ID: DTXSID20938477
• Wikidata: Q82914791
• Mol file: 17419-08-8.mol

Synonyms:4-N-phenylpyrimidine-2,4,6-triamine;17419-08-8;N4-phenyl-pyrimidine-2,4,6-triamine;NSC52862;SCHEMBL15305715;DTXSID20938477;NSC-52862;AKOS019336518;2-Imino-6-(phenylimino)-1,2,3,6-tetrahydropyrimidin-4-amine

Chemical Property of 4-N-phenylpyrimidine-2,4,6-triamine

Chemical Property:

• Vapor Pressure: 1.14E-10mmHg at 25°C
• Boiling Point: 513.8°Cat760mmHg
• Flash Point: 264.6°C
• PSA: 89.85000
• Density: 1.373g/cm³
• LogP: 2.62000
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 201.10144537
• Heavy Atom Count: 15
• Complexity: 192

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC2=NC(=NC(=C2)N)N

Technology Process of 4-N-phenylpyrimidine-2,4,6-triamine

There total 2 articles about 4-N-phenylpyrimidine-2,4,6-triamine 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:

6-chloro-pyrimidine-2,4-diyldiamine (156-83-2) + aniline (62-53-3) → N4-phenyl-pyrimidine-2,4,6-triamine (17419-08-8)

Guidance literature:

beim Erhitzen <96 h> in wss. Loesung vom pH 5-6;

DOI:10.1021/ja01151a011

Reference yield:

→ N4-phenyl-pyrimidine-2,4,6-triamine (17419-08-8)

Guidance literature:

4-Chlor-2,6-diamino-pyrimidin, Anilin, konz. HCl, bis 185grad, 20 Min.;

Reference yield:

N4-phenyl-pyrimidine-2,4,6-triamine (17419-08-8) → 9-phenylpurine-2,6-diamine (6318-28-1)

Guidance literature:

With acetic acid; sodium nitrite; Erwaermen des erhaltenen Nitroso-Derivats mit Na₂S₂O₄ in H₂O und Erwaermen des Reaktionsprodukts mit Formamid;

DOI:10.1021/ja01521a034

upstream raw materials:

6-chloro-pyrimidine-2,4-diyldiamine

aniline

Downstream raw materials:

9-phenylpurine-2,6-diamine

3-phenyl-3H-[1,2,3]triazolo[4,5-d]pyrimidine-5,7-diyldiamine