Chemical Properties
| Melting point | 194-195 °C |
| Density | 1.53±0.1 g/cm3(Predicted) |
| storage temp. | Store at -20°C |
| solubility | Soluble in DMSO |
| form | Powder |
| pka | 5.055±0.20(predicted) |
| color | White to off-white |
| InChI | InChI=1/C19H15F3N2O3/c20-19(21,22)9-3-1-8(2-4-9)16(25)23-24-17(26)14-10-5-6-11(13-7-12(10)13)15(14)18(24)27/h1-6,10-15H,7H2,(H,23,25)/t10-,11+,12+,13-,14-,15+ |
| InChIKey | CSKDFZIMJXRJGH-VWLPUNTINA-N |
| SMILES | C(NN1C(=O)[C@@]2([H])[C@@]([H])(C1=O)[C@@]1([H])C=C[C@]2([H])[C@]2([H])C[C@@]21[H])(=O)C1=CC=C(C(F)(F)F)C=C1 |&1:5,7,11,15,17,20,r| |
