4-(Boc-piperazin-1-yl)-3-nitrobenzoic a&
- Product Name4-(Boc-piperazin-1-yl)-3-nitrobenzoic a&
- CAS870703-72-3
- CBNumberCB6972831
- MFC16H21N3O6
- MW351.35
- MDL NumberMFCD07369744
- MOL File870703-72-3.mol
Chemical Properties
| Melting point: | 199-203 °C (dec.)(lit.) |
| Boiling point: | 529.2±50.0 °C(Predicted) |
| Density | 1.329±0.06 g/cm3(Predicted) |
| pka | 4.48±0.10(Predicted) |
| form | solid |
| InChI | 1S/C16H21N3O6/c1-16(2,3)25-15(22)18-8-6-17(7-9-18)12-5-4-11(14(20)21)10-13(12)19(23)24/h4-5,10H,6-9H2,1-3H3,(H,20,21) |
| InChIKey | CYGRJUZYSXUAMM-UHFFFAOYSA-N |
| SMILES | CC(C)(C)OC(=O)N1CCN(CC1)c2ccc(cc2[N+]([O-])=O)C(O)=O |
Safety
| Symbol(GHS) |
|
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| target organs | Respiratory system |
| PPE | dust mask type N95 (US), Eyeshields, Gloves |
| Hazard Codes | Xi |
| Risk Statements | 36/37/38 |
| Safety Statements | 26-36 |
| WGK Germany | 3 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications |
Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |