Substance Profile

1-isothiocyanato-2-methyl-propane

  • Molecular Formula: C5H9NS
  • Element System: C-H-N-S
  • CAS-RN: 591-82-2
  • InChI: InChI=1S/C5H9NS/c1-5(2)3-6-4-7/h5H,3H2,1-2H3
  • InChI Key: NSDDRJXKROCWRZ-UHFFFAOYSA-N

Chemical Properties + Synthesis

  • Molecular Weight: 115.1991
  • Calculated Log P: 2.846
  • Rotatable Bonds: 4
  • H Acceptors: 2
  • H Donators: 0
  • Reactions having this substance as a reactant: 12
  • Reactions having this substance as a product: 5
  • Journal articles containing this substance: 16
  • Patents containing this substance: 2
  • Other publications containing this substance:
  • Suppliers: ABCR, ASDI, Acros, Alfa Aesar, Apollo Scientific, Enamine, Maybridge, Oakwood, Otava, Sigma-Aldrich, SynQuest, VWR

Data from SPRESIweb

3D Interactive Structure