957198-31-1
| Name | 2-(Piperazin-1-yl)pyridine-4-boronic acid, pinacol ester |
| CAS | 957198-31-1 |
| Molecular Formula | C15H24BN3O2 |
| MDL Number | MFCD06795687 |
| Molecular Weight | 289.18 |
| MOL File | 957198-31-1.mol |
Chemical Properties
| Melting point | 112-116°C |
| Boiling point | 458.5±40.0 °C(Predicted) |
| density | 1.11±0.1 g/cm3(Predicted) |
| form | solid |
| pka | 8.65±0.10(Predicted) |
| InChI | 1S/C15H24BN3O2/c1-14(2)15(3,4)21-16(20-14)12-5-6-18-13(11-12)19-9-7-17-8-10-19/h5-6,11,17H,7-10H2,1-4H3 |
| InChIKey | LOZSSHYLDBDYSQ-UHFFFAOYSA-N |
| SMILES | CC1(C)OB(OC1(C)C)c2ccnc(c2)N3CCNCC3 |
| CAS DataBase Reference | 957198-31-1 |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HS Code | 2933998090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |