1,4,7-Triazecane

Base Information

• Chemical Name: 1,4,7-Triazecane
• CAS No.: 56575-49-6
• Molecular Formula: C7H17N3
• DSSTox Substance ID: DTXSID10413102
• Nikkaji Number: J351.555I
• Wikidata: Q82220919
• Mol file: 56575-49-6.mol

Synonyms:1,4,7-triazecane;1,4,7-triazacyclodecane;56575-49-6;1,4,7-Triazecine, decahydro-;SCHEMBL472220;DTXSID10413102;ITIURFCAPKNNCK-UHFFFAOYSA-N;AKOS006352886

Chemical Property of 1,4,7-Triazecane

Chemical Property:

• Vapor Pressure: 0.0379mmHg at 25°C
• XLogP3: -1.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 143.142247555
• Heavy Atom Count: 10
• Complexity: 67.3

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CNCCNCCNC1

Technology Process of 1,4,7-Triazecane

There total 3 articles about 1,4,7-Triazecane 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:

1,4,7-triazacyclodecane tritosylate → 1,4,7-triazacyclodecane (56575-49-6)

Guidance literature:

With sulfuric acid; at 120 ℃; for 30h; Yield given;

DOI:10.1002/hlca.19870700318

Reference yield:

1,4,7-tri(p-toluenesulfonyl)-1,4,7-triazacyclodecane (35980-65-5) → 1,4,7-triazacyclodecane (56575-49-6)

Guidance literature:

With hydrogen bromide; acetic acid; phenol; In water; for 24h; Heating;

Reference yield:

1,4,7-tris-(2-nitro-benzenesulfonyl)-[1,4,7]triazecane → 1,4,7-triazacyclodecane (56575-49-6)

Guidance literature:

With potassium carbonate; thiophenol;

DOI:10.1016/j.tetlet.2005.04.078

upstream raw materials:

1,4,7-tri(p-toluenesulfonyl)-1,4,7-triazacyclodecane