Substance Profile

4-Hexyl-bicyclo[2.2.2]octane-1-carboxylic acid 4'-cyano-biphenyl-4-yl ester

  • Molecular Formula: C28H33NO2
  • Element System: C-H-N-O
  • CAS-RN:
  • InChI: InChI=1S/C28H33NO2/c1-2-3-4-5-14-27-15-18-28(19-16-27,20-17-27)26(30)31-25-12-10-24(11-13-25)23-8-6-22(21-29)7-9-23/h6-13H,2-5,14-20H2,1H3
  • InChI Key: CQYURYIPTZNDOF-UHFFFAOYSA-N

Chemical Properties + Synthesis

  • Molecular Weight: 415.5745
  • Calculated Log P: 7.965
  • Rotatable Bonds: 11
  • H Acceptors: 2
  • H Donators: 0
  • Reactions having this substance as a reactant:
  • Reactions having this substance as a product: 1
  • Journal articles containing this substance: 1
  • Patents containing this substance:
  • Other publications containing this substance:
  • Suppliers:

Data from SPRESIweb

3D Interactive Structure