6-Methoxy-5-Nonanoyl-4-Oxo-4H-Pyran-2-Carbaldehyde

Molecule SVG Image

Properties Simple | Detailed

Formula C16H22O5
IUPAC Name 6-methoxy-5-nonanoyl-4-oxo-pyran-2-carbaldehyde
Molecular Mass 294.343 g·mol−1
Heat of Formation -778.2 ± 16.7 kJ·mol−1
Dipole Moment 4.29 ± 1.08 D
Volume 369.46 Å 3
Surface Area 345.02 Å 2
HOMO Energy -9.87 ± 0.55 eV
LUMO Energy -1.50 ± eV
Point Group Symmetry C1
Synonyms
  • 4-keto-6-methoxy-5-pelargonyl-pyran-2-carbaldehyde
  • 4h-pyran-2-carboxaldehyde, 6-methoxy-4-oxo-5-(1-oxononyl)-
  • 6-methoxy-4-oxo-5-(1-oxononyl)-2-pyrancarboxaldehyde
  • 6-methoxy-5-nonanoyl-4-oxopyran-2-carbaldehyde
  • phacidin
CAS Number(s)
  • 54835-75-5
InChIKey YTVPBUCDNKECDB-UHFFFAOYSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O