Ticagrelor iMpurity
- Product NameTicagrelor iMpurity
- CAS1882095-51-3
- MFC27H45N5O8S
- MW599.74
- EINECS
- MOL File1882095-51-3.mol
Chemical Properties
| Boiling point | 791.6±60.0 °C(Predicted) |
| Density | 1.35±0.1 g/cm3(Predicted) |
| pka | 14.03±0.10(Predicted) |
| InChIKey | YJVJBJBHQXNEMN-ZICWZDMONA-N |
| SMILES | N(C1=NC(SCCC)=NC(N[C@@H]2C[C@H](OCCO)[C@@]3([H])OC(C)(C)O[C@@]23[H])=C1N)[C@@H]1C[C@H](OCCO)[C@@]2([H])OC(C)(C)O[C@@]12[H] |&1:11,13,18,25,29,31,36,43,r| |