(9R,10S)-8-Allyl-9-(7-Methoxy-1,3-Benzodioxol-5-Yl)-10-Methyl-2,4-Dioxatricyclo[6.2.1.0~1,5~]Undec-5-En-7-One
Properties
Property | Value |
---|---|
Formula | C21H22O6 |
IUPAC Name | (1s,8s,9r,10s)-8-allyl-9-(7-methoxy-1,3-benzodioxol-5-yl)-10-methyl-2,4-dioxatricyclo[6.2.1.0 1,5 ]undec-5-en-7-one |
Molecular Mass | 370.396 g·mol−1 |
Heat of Formation | -676.9 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.21 ± 1.08 D |
Volume | 426.1 Å 3 |
Surface Area | 349.35 Å 2 |
HOMO Energy | -8.57 ± 0.55 eV |
LUMO Energy | 2.83 ± eV |
Point Group Symmetry | C1 |
InChIKey | VMBFNOIPGQFDTB-NIVSIOIYSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |