Methyl (2R,4S,6R,12S)-12-Isopropenyl-4-Methyl-8-Oxo-3,7,17-Trioxatetracyclo[12.2.1.1~6,9~.0~2,4~]Octadeca-1(16),9(18),14-Triene-15-Carboxylate
Properties
Property | Value |
---|---|
Formula | C21H24O6 |
IUPAC Name | methyl (2r,4s,6r,12s)-12-isopropenyl-4-methyl-8-oxo-3,7,17-trioxatetracyclo[12.2.1.1 6,9 .0 2,4 ]octadeca-1(16),9(18),14-triene-15-carboxylate |
Molecular Mass | 372.412 g·mol−1 |
Heat of Formation | -770.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.99 ± 1.08 D |
Volume | 444.51 Å 3 |
Surface Area | 359.17 Å 2 |
HOMO Energy | -9.51 ± 0.55 eV |
LUMO Energy | -0.44 ± eV |
Point Group Symmetry | C1 |
InChIKey | PPHCYWKQJLNLQQ-BFZSTLQHSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |