Chemical Properties
| Melting point | 237-238 °C |
| Boiling point | 753.3±60.0 °C(Predicted) |
| Density | 1.27±0.1 g/cm3(Predicted) |
| storage temp. | -20°C |
| pka | 4.25±0.70(Predicted) |
| form | solid |
| Major Application | metabolomics vitamins, nutraceuticals, and natural products |
| InChIKey | PUOQHFWXBKTHST-DLCGLXBKSA-N |
| SMILES | C[C@@H]1CC[C@@]2(CC[C@]3(C(O)=O)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2[C@H]1C)C(O)=O |
Safety Information
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Aquatic Chronic 4 |