S-Methyl 2,4-Dihydroxy-5-(3-Hydroxybutyl)-3,6-Dimethylbenzenecarbothioate
Properties
| Property | Value |
|---|---|
| Formula | C14H20O4S |
| IUPAC Name | s-methyl 2,4-dihydroxy-5-[(3r)-3-hydroxybutyl]-3,6-dimethyl-benzenecarbothioate |
| Molecular Mass | 284.371 g·mol−1 |
| Heat of Formation | -788.5 ± 16.7 kJ·mol−1 |
| Dipole Moment | 3.80 ± 1.08 D |
| Volume | 343.43 Å 3 |
| Surface Area | 306.86 Å 2 |
| HOMO Energy | -8.83 ± 0.55 eV |
| LUMO Energy | 2.76 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YIKHKZNDXADDGL-SSDOTTSWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | H S C O |