4-Oxo-4-(3-Pyridinyl)Butanal

Molecule SVG Image

Properties Simple | Detailed

Formula C9H9NO2
IUPAC Name 4-oxo-4-(3-pyridyl)butanal
Molecular Mass 163.173 g·mol−1
Heat of Formation -177.3 ± 16.7 kJ·mol−1
Dipole Moment 2.29 ± 1.08 D
Volume 198.26 Å 3
Surface Area 197.03 Å 2
HOMO Energy -10.37 ± 0.55 eV
LUMO Energy -1.05 ± eV
Point Group Symmetry Cs
Synonyms
  • 3-pyridinebutanal, gamma-oxo-
  • 4-keto-4-(3-pyridyl)butyraldehyde
  • 4-oxo-4-(3-pyridinebutanal)
  • 4-oxo-4-pyridin-3-yl-butanal
  • 4-oxo-4-pyridin-3-ylbutanal
CAS Number(s)
  • 76014-80-7
InChIKey CFONOJVUTZAMCB-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O N