5,6-Dihydroxy-O~15~-Methyl-5,6-Dihydroretinoic Acid
Properties
Property | Value |
---|---|
Formula | C21H32O4 |
IUPAC Name | methyl (2e,4e,6e,8e)-9-[(1r,2s)-1,2-dihydroxy-2,6,6-trimethyl-cyclohexyl]-3,7-dimethyl-nona-2,4,6,8-tetraenoate |
Molecular Mass | 348.476 g·mol−1 |
Heat of Formation | -755.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 3.23 ± 1.08 D |
Volume | 459.1 Å 3 |
Surface Area | 394.64 Å 2 |
HOMO Energy | -8.82 ± 0.55 eV |
LUMO Energy | -0.88 ± eV |
Point Group Symmetry | C1 |
InChIKey | RZAQIXABEIOMSQ-ZNFWXQDMSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H C O |