Substance Profile

4-Pentyl-benzoic acid 6-[2-(4-cyano-phenyl)-ethyl]-pyridin-3-yl ester

  • Molecular Formula: C26H26N2O2
  • Element System: C-H-N-O
  • CAS-RN:
  • InChI: InChI=1S/C26H26N2O2/c1-2-3-4-5-20-10-13-23(14-11-20)26(29)30-25-17-16-24(28-19-25)15-12-21-6-8-22(18-27)9-7-21/h6-11,13-14,16-17,19H,2-5,12,15H2,1H3
  • InChI Key: JGEHWRMPRFEGJG-UHFFFAOYSA-N

Chemical Properties + Synthesis

  • Molecular Weight: 398.5042
  • Calculated Log P: 6.124
  • Rotatable Bonds: 12
  • H Acceptors: 3
  • H Donators: 0
  • Reactions having this substance as a reactant:
  • Reactions having this substance as a product:
  • Journal articles containing this substance:
  • Patents containing this substance: 1
  • Other publications containing this substance:
  • Suppliers:

Data from SPRESIweb

3D Interactive Structure