870703-78-9
| Name | 2-(4-BOC-PIPERAZIN-1-YL)-3-BUTENOIC ACID |
| CAS | 870703-78-9 |
| Molecular Formula | C13H22N2O4 |
| MDL Number | MFCD07369763 |
| Molecular Weight | 270.32 |
| MOL File | 870703-78-9.mol |
Chemical Properties
| Melting point | 157 °C (D) (lit.) |
| Boiling point | 390.0±42.0 °C(Predicted) |
| density | 1.154±0.06 g/cm3(Predicted) |
| form | solid |
| pka | 1.96±0.10(Predicted) |
| InChI | 1S/C13H22N2O4/c1-5-10(11(16)17)14-6-8-15(9-7-14)12(18)19-13(2,3)4/h5,10H,1,6-9H2,2-4H3,(H,16,17) |
| InChIKey | ZXJMXILXWUNTEW-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)N1CCN(CC1)C(C=C)C(O)=O |
Safety Data
| Hazard Codes | Xi,N |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 3077 9/PG 3 |
| WGK Germany | 3 |
| HS Code | 2933599090 |
| Storage Class | 13 - Non Combustible Solids |
| Hazard Classifications | Aquatic Acute 1 Eye Dam. 1 |