Defluoro Aprepitant
- Product NameDefluoro Aprepitant
- CAS170729-76-7
- CBNumberCB22543774
- MFC23H22F6N4O3
- MW516.44
- MDL NumberMFCD24386573
- MOL File170729-76-7.mol
- MSDS FileSDS
Chemical Properties
| Density | 1.47±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 8.09±0.20(Predicted) |
| Appearance | White to off-white Solid |
| Major Application | pharmaceutical (small molecule) |
| InChIKey | YOBMIXIISZAQGF-CAYVGHNUSA-N |
| SMILES | FC(F)(F)c1cc(cc(c1)C(F)(F)F)[C@H](O[C@H]2OCCN([C@H]2c4ccccc4)Cc3[nH]nc(n3)O)C |
| FDA UNII | I8ZN5S5LTS |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |
