3,12-Dithiatricyclo[12.2.2.26,9]eicosa-6,7,8,14,16,17-hexaene

Base Information

• Chemical Name: 3,12-Dithiatricyclo[12.2.2.26,9]eicosa-6,7,8,14,16,17-hexaene
• CAS No.: 62587-08-0
• Molecular Formula: C₁₈H₂₀S₂
• Molecular Weight: 300.489
• DSSTox Substance ID: DTXSID801179985
• Mol file: 62587-08-0.mol

Synonyms:DTXSID801179985;3,12-Dithiatricyclo[12.2.2.26,9]eicosa-6,7,8,14,16,17-hexaene;62587-08-0

Chemical Property of 3,12-Dithiatricyclo[12.2.2.26,9]eicosa-6,7,8,14,16,17-hexaene

Chemical Property:

• XLogP3: 4.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 300.10064299
• Heavy Atom Count: 20
• Complexity: 235

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CSCC2=CC=C(CSCCC3=CC=C1C=C3)C=C2