6-Heptadecyl-1,3,5-triazine-2,4-diamine

Base Information

• Chemical Name: 6-Heptadecyl-1,3,5-triazine-2,4-diamine
• CAS No.: 2533-20-2
• Molecular Formula: C20H39 N5
• Molecular Weight: 349.563
• European Community (EC) Number: 219-794-7
• NSC Number: 7780
• UNII: FD3S8FKZ6Z
• DSSTox Substance ID: DTXSID30179970
• Nikkaji Number: J192.022G
• Wikidata: Q83050468
• Mol file: 2533-20-2.mol

Synonyms:STEAROGUANAMINE;6-Heptadecyl-1,3,5-triazine-2,4-diamine;2533-20-2;FD3S8FKZ6Z;NSC 7780;NSC-7780;EINECS 219-794-7;NSC7780;UNII-FD3S8FKZ6Z;2,4-DIAMINO-6-HEPTADECYL-S-TRIAZINE;SCHEMBL9488393;DTXSID30179970;C20H39N5;s-Triazine, 2,4-diamino-6-heptadecyl-;FT-0729986;1,3,5-Triazine-2,4-diamine, 6-heptadecyl-

Chemical Property of 6-Heptadecyl-1,3,5-triazine-2,4-diamine

Chemical Property:

• Vapor Pressure: 1.3E-11mmHg at 25°C
• Melting Point: 116-117 °C
• Boiling Point: 537.2°Cat760mmHg
• PKA: 4.46±0.10(Predicted)
• Flash Point: 312.3°C
• PSA: 90.71000
• Density: 0.987g/cm³
• LogP: 6.61230
• XLogP3: 8.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 16
• Exact Mass: 349.32054627
• Heavy Atom Count: 25
• Complexity: 277

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCCCC1=NC(=NC(=N1)N)N

Technology Process of 6-Heptadecyl-1,3,5-triazine-2,4-diamine

There total 5 articles about 6-Heptadecyl-1,3,5-triazine-2,4-diamine 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: 72.0%

2-heptadecyl-4,6-bis(trichloromethyl)-symm-triazine (24481-35-4) → 2,4-diamino-6-heptadecyl-symm-triazine (2533-20-2)

Guidance literature:

With ammonia; In N,N-dimethyl-formamide; at 150 - 155 ℃; for 2h;

DOI:10.1007/BF00515231

Reference yield:

N-Cyanoguanidine (127099-85-8,780722-26-1,461-58-5) + stearonitrile (638-65-3) → 2,4-diamino-6-heptadecyl-symm-triazine (2533-20-2)

Guidance literature:

With 2-ethoxy-ethanol; potassium hydroxide;

Reference yield:

Methyl stearate (112-61-8) + BIGUANIDE (56-03-1) → 2,4-diamino-6-heptadecyl-symm-triazine (2533-20-2)

Guidance literature:

upstream raw materials:

Methyl stearate

BIGUANIDE

Stearoyl chloride

N-Cyanoguanidine