(3S,4R,8R,9E,12R)-10-Methyl-5-Methylene-6,14-Dioxo-7,13-Dioxatricyclo[10.2.1.0~4,8~]Pentadeca-1(15),9-Dien-3-Yl Methacrylate

Molecule SVG Image

Properties Simple | Detailed

Formula C19H20O6
IUPAC Name [(3s,4r,8r,9e,12r)-10-methyl-5-methylene-6,14-dioxo-7,13-dioxatricyclo[10.2.1.04,8]pentadeca-1(15),9-dien-3-yl] 2-methylprop-2-enoate
Molecular Mass 344.359 g·mol−1
Heat of Formation -800.5 ± 16.7 kJ·mol−1
Dipole Moment 4.70 ± 1.08 D
Volume 402.37 Å 3
Surface Area 319.07 Å 2
HOMO Energy -9.92 ± 0.55 eV
LUMO Energy -0.80 ± eV
Point Group Symmetry C1
Synonyms
  • deoxyelephantopin
  • lmpr01030021
CAS Number(s)
  • 29307-03-7
InChIKey JMUOPRSXUVOHFE-GZZMZBIISA-N
QR Code Generate QR Code
Links PubChem ChemSpider
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O