4-Nitro-3-phenyl-L-alanine
- Product Name4-Nitro-3-phenyl-L-alanine
- CAS949-99-5
- MFC9H10N2O4
- MW210.19
- EINECS213-446-8
- MOL File949-99-5.mol
Chemical Properties
| Melting point | 236-239°C (dec.) |
| Boiling point | 414.1±35.0 °C(Predicted) |
| Density | 1.408±0.06 g/cm3(Predicted) |
| storage temp. | Keep in dark place,Inert atmosphere,Room temperature |
| solubility | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. |
| form | Powder |
| pka | 2.12±0.10(Predicted) |
| Appearance | Off-white to light brown Solid |
| InChI | InChI=1S/C9H10N2O4/c10-8(9(12)13)5-6-1-3-7(4-2-6)11(14)15/h1-4,8H,5,10H2,(H,12,13)/t8-/m0/s1 |
| InChIKey | GTVVZTAFGPQSPC-QMMMGPOBSA-N |
| SMILES | C(O)(=O)[C@H](CC1=CC=C([N+]([O-])=O)C=C1)N |
| CAS DataBase Reference | 949-99-5(CAS DataBase Reference) |
Safety Information
| Hazard Codes | Xn,C,F |
| Risk Statements | 36/37/38-22-34-11 |
| Safety Statements | 26-36/37/39-22-45-16 |
| RIDADR | 2811 |
| RTECS | AY7400000 |
| Hazard Note | Harmful |
| HS Code | 29224999 |