(2R,4A'R,7A'S,9A'R)-6',6'-Dimethyl-3'-Oxo-1',5',6',7',7A',9A'-Hexahydrospiro[Oxirane-2,4'-Pentaleno[1,6A-C]Pyran]-9'-Carboxylic Acid
Properties
Property | Value |
---|---|
Formula | C15H18O5 |
IUPAC Name | (1r,4ar,6as,9ar)-8,8-dimethyl-2-oxo-spiro[4a,6a,7,9-tetrahydro-4h-pentaleno[1,6a-c]pyran-1,2'-oxirane]-5-carboxylic acid |
Molecular Mass | 278.300 g·mol−1 |
Heat of Formation | -752.2 ± 16.7 kJ·mol−1 |
Dipole Moment | 5.33 ± 1.08 D |
Volume | 324.89 Å 3 |
Surface Area | 266.17 Å 2 |
HOMO Energy | -10.34 ± 0.55 eV |
LUMO Energy | -0.81 ± eV |
Point Group Symmetry | C1 |
InChIKey | UUDKOVSZNMZKND-BDAURDKOSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |