3-[(2S)-4-Acetoxy-1-Hydroxy-2-Butanyl]-4,5,7-Trihydroxy-9,10-Dioxo-9,10-Dihydro-2-Anthracenolate
Properties
| Property | Value |
|---|---|
| Formula | C20H17O9- |
| IUPAC Name | 3-[3-acetoxy-1-(hydroxymethyl)propyl]-4,5,7-trihydroxy-9,10-dioxo-anthracen-2-olate |
| Molecular Mass | 401.344 g·mol−1 |
| Heat of Formation | 708.8 ± 16.7 kJ·mol−1 |
| Dipole Moment | 2.10 ± 1.08 D |
| Volume | 438.8 Å 3 |
| Surface Area | 387.05 Å 2 |
| HOMO Energy | -9.22 ± 0.55 eV |
| LUMO Energy | -2.70 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BWYUKBCRHDFWFF-SECBINFHSA-M |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C O |