1217698-80-0
| Name | (trans-Racemic) 1-tert-Butyl 3-methyl 4-(5,6-di-methoxypyridin-3-yl)pyrrolidine-1,3-dicarboxylate |
| CAS | 1217698-80-0 |
| Molecular Formula | C18H26N2O6 |
| MDL Number | MFCD12401651 |
| Molecular Weight | 366.41 |
| MOL File | 1217698-80-0.mol |
Chemical Properties
| Boiling point | 450.5±45.0 °C(Predicted) |
| density | 1.182±0.06 g/cm3(Predicted) |
| form | solid |
| pka | 4.79±0.10(Predicted) |
| InChI | 1S/C18H26N2O6/c1-18(2,3)26-17(22)20-9-12(13(10-20)16(21)25-6)11-7-14(23-4)15(24-5)19-8-11/h7-8,12-13H,9-10H2,1-6H3/t12-,13+/m0/s1 |
| InChIKey | LDYJACAOCQSCIC-QWHCGFSZSA-N |
| SMILES | COC(=O)[C@@H]1CN(C[C@H]1c2cnc(OC)c(OC)c2)C(=O)OC(C)(C)C |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Oral |