117391-50-1
| Name | DL-beta-(3-Bromophenyl)alanine |
| CAS | 117391-50-1 |
| Molecular Formula | C9H10BrNO2 |
| MDL Number | MFCD00995843 |
| Molecular Weight | 244.09 |
| MOL File | 117391-50-1.mol |
Chemical Properties
| Melting point | 227 °C (dec.) (lit.) |
| Boiling point | 367.3±32.0 °C(Predicted) |
| density | 1.585±0.06 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| form | powder to crystal |
| pka | 3.60±0.10(Predicted) |
| color | White to Almost white |
| Major Application | peptide synthesis |
| InChI | 1S/C9H10BrNO2/c10-7-3-1-2-6(4-7)8(11)5-9(12)13/h1-4,8H,5,11H2,(H,12,13) |
| InChIKey | RLYAXKJHJUXZOT-UHFFFAOYSA-N |
| SMILES | NC(CC(O)=O)c1cccc(Br)c1 |
| CAS DataBase Reference | 117391-50-1(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P305+P351+P338 |
| WGK Germany | 3 |
| HS Code | 2922498590 |
| Storage Class | 13 - Non Combustible Solids |
