Ibuprofen Acyl-b-D-glucuronide
- Product NameIbuprofen Acyl-b-D-glucuronide
- CAS115075-59-7
- MFC19H26O8
- MW382.4
- EINECS
- MOL File115075-59-7.mol
Chemical Properties
| Melting point | 26-28°C |
| Boiling point | 567.3±50.0 °C(Predicted) |
| Density | 1.34±0.1 g/cm3(Predicted) |
| storage temp. | Hygroscopic, -20°C Freezer, Under Inert Atmosphere |
| solubility | Acetonitrile (Slightly, Heated), DMSO (Slightly), Methanol (Slightly, Sonicated) |
| pka | 2.68±0.70(Predicted) |
| color | White to Pale Yellow |
| Stability | Hygroscopic, Not stable in aqueous solutions. |
| Major Application | forensics and toxicology pharmaceutical (small molecule) |
| InChIKey | ABOLXXZAJIAUGR-JPMMFUSZSA-N |
| SMILES | CC(C)Cc1ccc(cc1)C(C)C(=O)O[C@@H]2O[C@@H]([C@@H](O)[C@H](O)[C@H]2O)C(O)=O |