879880-79-2
| Name | Shi Epoxidation Oxazolidinone Ethyl Catalyst |
| CAS | 879880-79-2 |
| Molecular Formula | C18H21NO6 |
| MDL Number | MFCD17019350 |
| Molecular Weight | 347.36 |
| MOL File | 879880-79-2.mol |
Chemical Properties
| Melting point | 139-143°C |
| Boiling point | 505.6±50.0 °C(Predicted) |
| density | 1.35±0.1 g/cm3(Predicted) |
| storage temp. | -20°C |
| form | solid |
| pka | 0.54±0.40(Predicted) |
| Optical Rotation | [α]22/D 17.0°, c = 0.5 in chloroform |
| InChI | 1S/C18H21NO6/c1-4-11-5-7-12(8-6-11)19-10-18(25-16(19)21)15(20)14-13(9-22-18)23-17(2,3)24-14/h5-8,13-14H,4,9-10H2,1-3H3/t13-,14-,18+/m1/s1 |
| InChIKey | FLYFZOSQSKQBNR-LBTNJELSSA-N |
| SMILES | CCc1ccc(cc1)N2C[C@]3(OC[C@H]4OC(C)(C)O[C@H]4C3=O)OC2=O |