Cyclanoline

Base Information

• Chemical Name: Cyclanoline
• CAS No.: 18556-27-9
• Molecular Formula: C20H24 N O4
• Molecular Weight: 0
• UNII: 77QC59KBD2
• DSSTox Substance ID: DTXSID00171789
• Nikkaji Number: J15.775I
• Wikipedia: Cyclanoline
• Wikidata: Q15410909
• Mol file: 18556-27-9.mol

Synonyms:cissamine;cyclanoline;cyclanoline chloride, (7S-cis)-isomer

Chemical Property of Cyclanoline

Chemical Property:

• PSA: 58.92000
• LogP: 2.87390
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 342.17053325
• Heavy Atom Count: 25
• Complexity: 488

Purity/Quality:

≥98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[N+]12CCC3=CC(=C(C=C3C1CC4=C(C2)C(=C(C=C4)OC)O)O)OC
• Isomeric SMILES: C[N@@+]12CCC3=CC(=C(C=C3[C@@H]1CC4=C(C2)C(=C(C=C4)OC)O)O)OC