3,6,9,12,18-Pentaazabicyclo[12.3.1]octadeca-1(18),14,16-triene

Base Information

• Chemical Name: 3,6,9,12,18-Pentaazabicyclo[12.3.1]octadeca-1(18),14,16-triene
• CAS No.: 78668-33-4
• Molecular Formula: C13H23N5
• DSSTox Substance ID: DTXSID00458789
• Nikkaji Number: J764.117F
• Wikidata: Q82282312

Synonyms:3,6,9,12,18-Pentaazabicyclo[12.3.1]octadeca-1(18),14,16-triene;78668-33-4;SCHEMBL8235408;DTXSID00458789;3,6,9,12,18-pentazabicyclo[12.3.1]octadeca-1(18),14,16-triene

Chemical Property of 3,6,9,12,18-Pentaazabicyclo[12.3.1]octadeca-1(18),14,16-triene

Chemical Property:

• XLogP3: -1.4
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 0
• Exact Mass: 249.19534575
• Heavy Atom Count: 18
• Complexity: 192

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCCNCC2=CC=CC(=N2)CNCCN1

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