Sitagliptin IMpurity
- Product NameSitagliptin IMpurity
- CAS1675201-14-5
- MFC16H12F6N4O
- MW390.28
- EINECS
- MOL File1675201-14-5.mol
Chemical Properties
| Melting point | 113-115°C |
| Boiling point | 504.1±60.0 °C(Predicted) |
| Density | 1.52±0.1 g/cm3(Predicted) |
| storage temp. | -20°C Freezer, Under inert atmosphere |
| solubility | Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly) |
| form | Solid |
| pka | -0.03±0.20(Predicted) |
| color | White to Off-White |
| InChI | InChI=1S/C16H12F6N4O/c17-10-7-12(19)11(18)6-9(10)2-1-3-14(27)25-4-5-26-13(8-25)23-24-15(26)16(20,21)22/h1-2,6-7H,3-5,8H2 |
| InChIKey | BLDAVCZELRQXFP-UHFFFAOYSA-N |
| SMILES | C(N1CCN2C(C(F)(F)F)=NN=C2C1)(=O)CC=CC1=CC(F)=C(F)C=C1F |
