Substance Profile

3-trifluoromethyl-benzonitrile

  • Molecular Formula: C8H4F3N
  • Element System: C-F-H-N
  • CAS-RN: 368-77-4
  • InChI: InChI=1S/C8H4F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4H
  • InChI Key: OGOBINRVCUWLGN-UHFFFAOYSA-N

Chemical Properties + Synthesis

  • Molecular Weight: 171.1206
  • Calculated Log P: 2.538
  • Rotatable Bonds: 2
  • H Acceptors: 1
  • H Donators: 0
  • Reactions having this substance as a reactant: 40
  • Reactions having this substance as a product: 9
  • Journal articles containing this substance: 27
  • Patents containing this substance: 5
  • Other publications containing this substance:
  • Suppliers: ABCR, Acros, Alfa Aesar, Apexmol, Apollo Scientific, Ark Pharm, ChemCollect, ChemPacific, ChemiK, Enamine, Oakwood, Otava, Sigma-Aldrich, Sinova, SynQuest, VWR

Data from SPRESIweb

3D Interactive Structure