Sitagliptin Defuoro IMpurity 3
- Product NameSitagliptin Defuoro IMpurity 3
- CAS851307-12-5
- MFC15H19F2NO4
- MW315.31
- EINECS
- MOL File851307-12-5.mol
Chemical Properties
| Boiling point | 444.3±45.0 °C(Predicted) |
| Density | 1.243±0.06 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| pka | 4.37±0.10(Predicted) |
| Appearance | white solid |
| InChI | InChI=1/C15H19F2NO4/c1-15(2,3)22-14(21)18-11(8-13(19)20)6-9-4-5-10(16)7-12(9)17/h4-5,7,11H,6,8H2,1-3H3,(H,18,21)(H,19,20)/t11-/s3 |
| InChIKey | LUYHWLQWAVCDNA-LBPXTSNRNA-N |
| SMILES | C(O)(=O)C[C@H](NC(OC(C)(C)C)=O)CC1=CC=C(F)C=C1F |&1:4,r| |
![(3R)-3-[(tert-Butoxycarbonyl)amino]-4-(2,4-difluorophenyl)butanoic acid pictures](/ProductImageEN/2021-09/Small/74db5abb-acd3-4157-9bb1-b5029994e563.png)
![(3R)-3-[(tert-Butoxycarbonyl)amino]-4-(2,4-difluorophenyl)butanoic acid pictures](/ProductImageEN/2021-09/Small/3a842a5f-4f9a-400b-b285-b685e4791779.png)