1,3,5,7-Tetrazocane

Base Information

• Chemical Name: 1,3,5,7-Tetrazocane
• CAS No.: 6054-74-6
• Molecular Formula: C4H12 N4
• Molecular Weight: 116.16488
• European Community (EC) Number: 227-969-4
• UNII: PV8EE8H6Q5
• DSSTox Substance ID: DTXSID5064097
• Nikkaji Number: J227.268G
• Wikidata: Q27117976
• Metabolomics Workbench ID: 56002
• Mol file: 6054-74-6.mol

Synonyms:1,3,5,7-tetrazocane;Octahydro-1,3,5,7-tetrazocine;6054-74-6;1,3,5,7-Tetrazocine, octahydro-;1,3,5,7-tetraazacyclooctane;EINECS 227-969-4;PV8EE8H6Q5;1,3,5,7-Octahydro-1,3,5,7-tetrazocine;UNII-PV8EE8H6Q5;SCHEMBL4140732;DTXSID5064097;CHEBI:38789;Q27117976;2-Pyrrolidinone, 5-methyl-1-phenyl-3-piperidino-, hydrochloride,trans-

Chemical Property of 1,3,5,7-Tetrazocane

Chemical Property:

• Vapor Pressure: 13.6mmHg at 25°C
• Boiling Point: 122.9°C at 760 mmHg
• Flash Point: 17.9°C
• PSA: 48.12000
• Density: 0.921g/cm³
• LogP: -0.49640
• XLogP3: -1.3
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 116.106196400
• Heavy Atom Count: 8
• Complexity: 32

Purity/Quality:

99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1NCNCNCN1