3-[(3As,4S,7As)-7A-Methyl-5-Oxooctahydro-1H-Inden-4-Yl]Propanoic Acid
Properties
Property | Value |
---|---|
Formula | C13H20O3 |
IUPAC Name | 3-[(3ar,4s,7as)-7a-methyl-5-oxo-2,3,3a,4,6,7-hexahydro-1h-inden-4-yl]propanoic acid |
Molecular Mass | 224.296 g·mol−1 |
Heat of Formation | -707.1 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.30 ± 1.08 D |
Volume | 287.83 Å 3 |
Surface Area | 252.81 Å 2 |
HOMO Energy | -9.96 ± 0.55 eV |
LUMO Energy | 0.49 ± eV |
Point Group Symmetry | C1 |
InChIKey | QSTIBJYLKKHROX-CWSCBRNRSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |