1,4,7-Triazecan-9-ol

Base Information

• Chemical Name: 1,4,7-Triazecan-9-ol
• CAS No.: 547756-15-0
• Molecular Formula: C7H17N3O
• Molecular Weight: 159.22938
• DSSTox Substance ID: DTXSID20435330
• Nikkaji Number: J2.018.265B
• ChEMBL ID: CHEMBL57063
• Mol file: 547756-15-0.mol

Synonyms:1,4,7-triazecan-9-ol;547756-15-0;1,4,7-Triazecin-9-ol, decahydro- (9CI);1,4,7-Triazecin-9-ol,decahydro-(9CI);CHEMBL57063;1,4,7-Triazacyclodecane-9-ol;DTXSID20435330

Chemical Property of 1,4,7-Triazecan-9-ol

Chemical Property:

• Boiling Point: 333.1±37.0 °C(Predicted)
• PKA: 14.39±0.20(Predicted)
• PSA: 56.32000
• Density: 0.979±0.06 g/cm3(Predicted)
• LogP: -0.88390
• XLogP3: -1.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 159.137162174
• Heavy Atom Count: 11
• Complexity: 89.7

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNCC(CNCCN1)O

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