(1S,4Ar,5S)-5-[(3S)-4-Carboxy-3-Methylbutyl]-1,4A-Dimethyl-6-Methylenedecahydro-1-Naphthalenecarboxylic Acid
Properties
Property | Value |
---|---|
Formula | C20H32O4 |
IUPAC Name | (1r,4as,5r,8ar)-5-[(3s)-4-carboxy-3-methyl-butyl]-1,4a-dimethyl-6-methylene-decalin-1-carboxylic acid |
Molecular Mass | 336.466 g·mol−1 |
Heat of Formation | -978.7 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.27 ± 1.08 D |
Volume | 439.25 Å 3 |
Surface Area | 352.14 Å 2 |
HOMO Energy | -9.69 ± 0.55 eV |
LUMO Energy | 0.92 ± eV |
Point Group Symmetry | C1 |
InChIKey | HPQKNJHVWUWAOR-FQCQXKDLSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |