| Melting point |
207°C (dec.) |
| Boiling point |
555.6±60.0 °C(Predicted) |
| Density |
1.459±0.06 g/cm3(Predicted) |
| storage temp. |
-20°C Freezer |
| solubility |
Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
| pka |
9.04±0.10(Predicted) |
| form |
Solid |
| color |
White to Off-White |
| Major Application |
pharmaceutical |
| InChI |
InChI=1S/C16H14F3N3O3S/c1-10-13(20-7-6-14(10)25-9-16(17,18)19)8-26(23,24)15-21-11-4-2-3-5-12(11)22-15/h2-7H,8-9H2,1H3,(H,21,22) |
| InChIKey |
TVMJMCGRSSSSDJ-UHFFFAOYSA-N |
| SMILES |
C1(S(CC2=NC=CC(OCC(F)(F)F)=C2C)(=O)=O)NC2=CC=CC=C2N=1 |
| CAS DataBase Reference |
131926-99-3 |
