16-Azabicyclo[10.3.1]hexadeca-1(16),12,14-triene

Base Information

• Chemical Name: 16-Azabicyclo[10.3.1]hexadeca-1(16),12,14-triene
• CAS No.: 4432-68-2
• Molecular Formula: C15H23N
• Molecular Weight: 217.354
• DSSTox Substance ID: DTXSID70415703
• Nikkaji Number: J1.874.907F
• Wikidata: Q82224676
• Mol file: 4432-68-2.mol

Synonyms:Normuscopyridine;16-azabicyclo[10.3.1]hexadeca-1(16),12,14-triene;4432-68-2;DTXSID70415703

Chemical Property of 16-Azabicyclo[10.3.1]hexadeca-1(16),12,14-triene

Chemical Property:

• PSA: 12.89000
• LogP: 4.30100
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 217.183049738
• Heavy Atom Count: 16
• Complexity: 160

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCCCCC2=CC=CC(=N2)CCCC1

Technology Process of 16-Azabicyclo[10.3.1]hexadeca-1(16),12,14-triene

There total 1 articles about 16-Azabicyclo[10.3.1]hexadeca-1(16),12,14-triene 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:

2,4,5,6,7,8,9,10,11,12,13,13a-dodecahydro-1H-cyclopentacyclododecene (80015-11-8) → <10>(2,6)pyridinophane (4432-68-2) + 5,6,7,8,9,10,11,12,13,14-decahydrocyclododecapyridine (6571-43-3)

Guidance literature:

With hydrogen azide; ethanol; chloroform; sulfuric acid; Erhitzen einer Loesung des Reaktionsprodukts in 1-Methyl-naphthalin mit Palladium/Kohle unter Kohlendioxid;

DOI:10.1021/ja01577a061

upstream raw materials:

2,4,5,6,7,8,9,10,11,12,13,13a-dodecahydro-1H-cyclopentacyclododecene