Cyanuric triazide

Base Information

• Chemical Name: Cyanuric triazide
• CAS No.: 5637-83-2
• Molecular Formula: C3N12
• Molecular Weight: 204.113
• NSC Number: 518308
• UNII: P5JCR9JM71
• DSSTox Substance ID: DTXSID40971806
• Nikkaji Number: J91.048A
• Wikipedia: Cyanuric_triazide
• Wikidata: Q1147038
• Mol file: 5637-83-2.mol

Synonyms:2,4,6-triazido-1,3,5-triazine;TATA cpd

Chemical Property of Cyanuric triazide

Chemical Property:

• Refractive Index: 1.4000 (estimate)
• Boiling Point: 351.74°C (rough estimate)
• PSA: 187.92000
• Density: 2.2785 (estimate)
• LogP: 1.05528
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 3
• Exact Mass: 204.03688805
• Heavy Atom Count: 15
• Complexity: 284

Purity/Quality:

99% ^*data from raw suppliers

2,4,6-TRIAZIDO-1,3,5-TRIAZINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=NC(=NC(=N1)N=[N+]=[N-])N=[N+]=[N-])N=[N+]=[N-]

Technology Process of Cyanuric triazide

There total 3 articles about Cyanuric triazide 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: 79.0%

1,3,5-trichloro-2,4,6-triazine (108-77-0) → 2,4,6-triazido-[1,3,5]triazine (5637-83-2)

Guidance literature:

With sodium azide; In water; acetone; at 30 ℃; for 2h;

DOI:10.1039/c9cc09465b

Reference yield:

→ 2,4,6-triazido-[1,3,5]triazine (5637-83-2)

Guidance literature:

With cis-nitrous acid;

Reference yield:

→ 2,4,6-triazido-[1,3,5]triazine (5637-83-2)

Guidance literature:

Cyanursaeuretrichlorid, NaN3;

upstream raw materials:

1,3,5-trichloro-2,4,6-triazine

Downstream raw materials:

ethanedinitrile

2,4,6-triamino-s-triazine

isocyanuric acid

Refernces

• 1、 Du Bois, Derek R.,Foroughi, Leila M.,Matzger, Adam J.,Wiscons, Ren A.. "Improving stability of the metal-free primary energetic cyanuric triazide (CTA) through cocrystallization". . p. 2111 - 2114. Retrieved 2020.
• 2、 Shastin, Aleksey V.,Petrov, Artem O.,Malkov, Georgiy V.,Gavrishova, Tatiana N.. "Synthesis of azidopropargylamino-substituted 1,3,5-triazines – novel monomers for the production of energetic polymers". . p. 866 - 870. Retrieved 2021/09/08.