Aliskiren
- Product NameAliskiren
- CAS173334-57-1
- CBNumberCB9966226
- MFC30H53N3O6
- MW551.76
- EINECS605-672-4
- MDL NumberMFCD09839018
- MOL File173334-57-1.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 98-99 °C |
| Boiling point | 748.4±60.0 °C(Predicted) |
| Density | 1.067±0.06 g/cm3(Predicted) |
| storage temp. | Inert atmosphere,Store in freezer, under -20°C |
| solubility | DMSO : 100 mg/mL (181.24 mM; Need ultrasonic) |
| form | Powder |
| pka | 9.49(at 25℃) |
| color | White to light yellow |
| InChIKey | UXOWGYHJODZGMF-PPPRLRNRNA-N |
| SMILES | C(C)(C)(CNC(=O)[C@H](C(C)C)C[C@H](O)[C@@H](N)C[C@@H](C(C)C)CC1C=CC(OC)=C(OCCCOC)C=1)C(N)=O |&1:7,12,14,17,r| |
| CAS DataBase Reference | 173334-57-1(CAS DataBase Reference) |
| FDA UNII | 502FWN4Q32 |
| ATC code | C09XA02 |
| UNSPSC Code | 12352200 |
| NACRES | NA.21 |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| WGK Germany | WGK 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
| Hazardous Substances Data | 173334-57-1(Hazardous Substances Data) |