6-(3-Hydroxy-2-Butanyl)-5-(Hydroxymethyl)-4-Methoxy-2H-Pyran-2-One
Properties
| Property | Value |
|---|---|
| Formula | C11H16O5 |
| IUPAC Name | 5-(hydroxymethyl)-6-[(1r,2r)-2-hydroxy-1-methyl-propyl]-4-methoxy-pyran-2-one |
| Molecular Mass | 228.242 g·mol−1 |
| Heat of Formation | -867.2 ± 16.7 kJ·mol−1 |
| Dipole Moment | 4.17 ± 1.08 D |
| Volume | 272.78 Å 3 |
| Surface Area | 241.34 Å 2 |
| HOMO Energy | -9.78 ± 0.55 eV |
| LUMO Energy | -0.93 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | BSXCHPRMOOSCRM-RNFRBKRXSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H C O |