1-Vinyltriazole

Base Information

• Chemical Name: 1-Vinyltriazole
• CAS No.: 41917-22-0
• Molecular Formula: C4H5N3
• Molecular Weight: 95.1038
• European Community (EC) Number: 897-620-4
• DSSTox Substance ID: DTXSID60461835
• Wikidata: Q82286265
• Mol file: 41917-22-0.mol

Synonyms:1-vinyltriazole;1-ethenyltriazole;41917-22-0;1-ethenyl-1H-1,2,3-triazole;1-vinyl-1h-1,2,3-triazole;n-vinyltriazole;starbld0035413;DTXSID60461835;GIVBQSUFWURSOS-UHFFFAOYSA-N;EN300-2008887

Chemical Property of 1-Vinyltriazole

Chemical Property:

• PSA: 30.71000
• LogP: 0.37860
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 95.048347172
• Heavy Atom Count: 7
• Complexity: 71.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CN1C=CN=N1

Technology Process of 1-Vinyltriazole

There total 1 articles about 1-Vinyltriazole 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: 40.0%

acetylene (74-86-2,25067-58-7) → 1,2,3-triazole (288-36-8) + N-vinyl-1,2,3-triazole (41917-22-0)

Guidance literature:

With sodium azide; sulfuric acid; In water; benzene; at 100 ℃; for 60h; under 11400 - 12160 Torr;

DOI:10.1023/A:1020874201056

Reference yield:

C-[(tert-butyldiphenylsilyl)oxy]-N-methyl nitrone (946078-38-2,409319-04-6) + N-vinyl-1,2,3-triazole (41917-22-0) → C23H30N4O2Si + C23H30N4O2Si

Guidance literature:

In chloroform; at 80 ℃; for 2h; regioselective reaction; Sealed tube; Microwave irradiation;

DOI:10.1016/j.bmc.2013.10.001

upstream raw materials:

acetylene