Bicyclo[12.4.0]octadeca-1,3,5,7,9,11,13,15,17-nonaene

Base Information

• Chemical Name: Bicyclo[12.4.0]octadeca-1,3,5,7,9,11,13,15,17-nonaene
• CAS No.: 266-58-0
• Molecular Formula: C18H16
• Molecular Weight: 232.32000
• DSSTox Substance ID: DTXSID70502329
• Nikkaji Number: J1.655.481B
• Mol file: 266-58-0.mol

Synonyms:266-58-0;DTXSID70502329;(4aE,6Z,8E,10Z,12E,14Z,16E)-Benzo[14]annulene

Chemical Property of Bicyclo[12.4.0]octadeca-1,3,5,7,9,11,13,15,17-nonaene

Chemical Property:

• Melting Point: 106-108 °C (decomp)
• Boiling Point: 494.5±12.0 °C(Predicted)
• PSA: 0.00000
• Density: 0.956±0.06 g/cm3(Predicted)
• LogP: 5.08860
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 232.125200510
• Heavy Atom Count: 18
• Complexity: 489

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=CC=CC=C2C=CC=CC2=CC=CC=C1