Methyl (2'R,3R,5S,5'R)-5-(3-Furyl)-2',5'-Dimethyl-2-Oxo-3',4,4',5,5',6',7',8'-Octahydro-2'H-Spiro[Furan-3,1'-Naphthalene]-5'-Carboxylate
Properties
Property | Value |
---|---|
Formula | C21H26O5 |
IUPAC Name | methyl (1r,5r,5's,6r)-5'-(3-furyl)-1,6-dimethyl-2'-oxo-spiro[2,3,4,6,7,8-hexahydronaphthalene-5,3'-tetrahydrofuran]-1-carboxylate |
Molecular Mass | 358.428 g·mol−1 |
Heat of Formation | -817.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.18 ± 1.08 D |
Volume | 432.46 Å 3 |
Surface Area | 338.91 Å 2 |
HOMO Energy | -9.34 ± 0.55 eV |
LUMO Energy | 0.23 ± eV |
Point Group Symmetry | C1 |
InChIKey | CRSACJNXOSEYLN-GJBMWOIVSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |