1-(1,2,3,6-Tetrahydro-1-Methyl-4-Pyridinyl)Ethanone

Molecule SVG Image

Properties Simple | Detailed

Formula C8H13NO
IUPAC Name 1-[(1r)-1-methyl-3,6-dihydro-2h-pyridin-4-yl]ethanone
Molecular Mass 139.195 g·mol−1
Heat of Formation -126.3 ± 16.7 kJ·mol−1
Dipole Moment 3.30 ± 1.08 D
Volume 185.95 Å 3
Surface Area 184.51 Å 2
HOMO Energy -8.97 ± 0.55 eV
LUMO Energy 0.10 ± eV
Point Group Symmetry C1
Synonyms
  • 1-(1-methyl-3,6-dihydro-2h-pyridin-4-yl)ethanone
  • ethanone, 1-(1,2,3,6-tetrahydro-1-methyl-4-pyridinyl)-
  • isoarecolone
CAS Number(s)
  • 100752-88-3
InChIKey YYJCSIKNHFNEQM-UHFFFAOYSA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N