| CAS | 170729-80-3 |
|---|---|
| Chemical Name or Material | Aprepitant |
| Formula Weight | 534.43 |
| IUPAC Name | 5-{[(2S,3R)-2-[(1R)-1-[3,5-bis(trifluoromethyl)phenyl]ethoxy]-3-(4-fluorophenyl)morpholin-4-yl]methyl}-2,3-dihydro-1H-1,2,4-triazol-3-one |
| InChI Key | ATALOFNDEOCMKK-BYYRLHKVSA-N |
| Molecular Formula | C23H21F7N4O3 |
| Purity | ≥97.5% (HPLC) |
| Quantity | 1 g |
| SMILES | C[C@@H](O[C@@H]1OCCN(CC2=NC(=O)NN2)[C@@H]1C1=CC=C(F)C=C1)C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F |
| Solubility | practically insoluble |
| Molecular Weight (g/mol) | 534.44 |
| Physical Form | Powder |
| Product Type | Reagent |
| Unit Size | Each |
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