(1R,2S,4R,8S,9R,11S)-1-Hydroxy-2,11-Dimethyl-7-Methylene-6-Oxo-5,14-Dioxatricyclo[9.2.1.0~4,8~]Tetradec-9-Yl 2-Methylpropanoate

Molecule SVG Image

Properties Simple | Detailed

Formula C19H28O6
IUPAC Name (1r,2s,4r,8s,9r,11s)-1-hydroxy-2,11-dimethyl-7-methylene-6-oxo-5,14-dioxatricyclo[9.2.1.0 4,8 ]tetradec-9-yl 2-methylpropanoate
Molecular Mass 352.422 g·mol−1
Heat of Formation -1203.6 ± 16.7 kJ·mol−1
Dipole Moment 5.29 ± 1.08 D
Volume 431.35 Å 3
Surface Area 333.96 Å 2
HOMO Energy -10.17 ± 0.55 eV
LUMO Energy 0.03 ± eV
Point Group Symmetry C1
InChIKey VKWNXJLVNFOOOS-QNIDSSLUSA-N
QR Code Generate QR Code
DOI
Downloads Get JSON data Get MOL2 data Get SVG Image
Elements H C O