111821-49-9
| Name | 4-BORONO-D-PHENYLALANINE B10 ENRICHED |
| CAS | 111821-49-9 |
| Molecular Formula | C9H12BNO4 |
| MDL Number | MFCD03452760 |
| Molecular Weight | 209.01 |
| MOL File | 111821-49-9.mol |
Chemical Properties
| Appearance | white crystalline powder |
| Boiling point | 449.3±55.0 °C(Predicted) |
| density | 1.34±0.1 g/cm3(Predicted) |
| storage temp. | 2-8°C |
| form | solid |
| pka | 2.20±0.10(Predicted) |
| Optical Rotation | [α]/D +6.0±1.0°, c = 0.5 in 2% HCl |
| BRN | 9202597 |
| Major Application | peptide synthesis |
| InChI | 1S/C9H12BNO4/c11-8(9(12)13)5-6-1-3-7(4-2-6)10(14)15/h1-4,8,14-15H,5,11H2,(H,12,13)/t8-/m1/s1 |
| InChIKey | NFIVJOSXJDORSP-MRVPVSSYSA-N |
| SMILES | N[C@H](Cc1ccc(cc1)B(O)O)C(O)=O |
| CAS DataBase Reference | 111821-49-9(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P302+P352-P305+P351+P338 |
| Hazard Codes | Xi,Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| RTECS | AY4240000 |
| HazardClass | IRRITANT |
| HS Code | 29310099 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |