(3Br,9Bs)-9-Hydroxy-7-Isopropyl-6-Methoxy-9B-Methyl-3B,4,5,9B,10,11-Hexahydrophenanthro[1,2-C]Furan-1(3H)-One
Properties
Property | Value |
---|---|
Formula | C21H26O4 |
IUPAC Name | (3br,9bs)-9-hydroxy-7-isopropyl-6-methoxy-9b-methyl-3,3b,4,5,10,11-hexahydronaphtho[2,1-e]isobenzofuran-1-one |
Molecular Mass | 342.429 g·mol−1 |
Heat of Formation | -654.5 ± 16.7 kJ·mol−1 |
Dipole Moment | 7.04 ± 1.08 D |
Volume | 417.77 Å 3 |
Surface Area | 344.32 Å 2 |
HOMO Energy | -8.96 ± 0.55 eV |
LUMO Energy | -0.12 ± eV |
Point Group Symmetry | C1 |
Synonyms |
|
CAS Number(s) |
|
InChIKey | YQHBJMHUMJXFDN-KKSFZXQISA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |