Skatole

Molecule SVG Image

Properties Simple | Detailed

Formula C9H9N
IUPAC Name 3-methylindol-1-ium
Molecular Mass 131.174 g·mol−1
Heat of Formation 140.9 ± 16.7 kJ·mol−1
Dipole Moment 1.63 ± 1.08 D
Volume 168.28 Å 3
Surface Area 169.87 Å 2
HOMO Energy -8.36 ± 0.55 eV
LUMO Energy -0.27 ± eV
Point Group Symmetry Cs
Synonyms
  • .beta.-methylindole
  • 1h-indole, 3-methyl-
  • 3-methyl-1h-indole
  • 3-methyl-4,5-benzopyrrole
  • 3-methylindole
  • 3-mi
  • beta-methylindole
  • indole, 3-methyl-
  • scatole
  • skatol
CAS Number(s)
  • 83-34-1
InChIKey ZFRKQXVRDFCRJG-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C N