2-[(4-Methylphenyl)Sulfanyl]-1-(1-Piperidinyl)Ethanone

Molecule SVG Image

Properties Simple | Detailed

Formula C14H19NOS
IUPAC Name 1-(1-piperidyl)-2-(p-tolylsulfanyl)ethanone
Molecular Mass 249.372 g·mol−1
Heat of Formation -150.3 ± 16.7 kJ·mol−1
Dipole Moment 5.14 ± 1.08 D
Volume 312.89 Å 3
Surface Area 286.51 Å 2
HOMO Energy -8.17 ± 0.55 eV
LUMO Energy -0.32 ± eV
Point Group Symmetry C1
Synonyms
  • 2-(4-methylphenyl)sulfanyl-1-(1-piperidyl)ethanone
  • 2-(4-methylphenyl)sulfanyl-1-piperidin-1-yl-ethanone
  • 2-(4-methylphenyl)sulfanyl-1-piperidin-1-ylethanone
  • 2-[(4-methylphenyl)thio]-1-(1-piperidyl)ethanone
  • 2-[(4-methylphenyl)thio]-1-piperidino-ethanone
  • iflab1_004251
  • iflab2_000127
InChIKey SHRAJQKNTTWFAA-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C S O N