26112-88-9
| Name | 2-O-(P-NITROPHENYL)-ALPHA-D-N-ACETYLNEURAMINIC ACID |
| CAS | 26112-88-9 |
| Molecular Formula | C17H22N2O11 |
| MDL Number | MFCD00132944 |
| Molecular Weight | 430.36 |
| MOL File | 26112-88-9.mol |
Chemical Properties
| Boiling point | 853.315±65.00 °C(Press: 760.00 Torr)(predicted) |
| density | 1.613±0.10 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted) |
| storage temp. | -20°C |
| solubility | methanol: 25mg/mL, clear, colorless to faintly yellow |
| form | powder |
| pka | 1.391±0.70(predicted) |
| InChI | 1S/C17H22N2O11/c1-8(21)18-13-11(22)6-17(16(25)26,30-15(13)14(24)12(23)7-20)29-10-4-2-9(3-5-10)19(27)28/h2-5,11-15,20,22-24H,6-7H2,1H3,(H,18,21)(H,25,26) |
| InChIKey | OICUZSPXIJAAEA-UHFFFAOYSA-N |
| SMILES | CC(=O)NC1C(O)CC(OC1C(O)C(O)CO)(Oc2ccc(cc2)N(=O)=O)C(O)=O |
Safety Data
| Hazard Codes | T |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Dermal Acute Tox. 3 Inhalation Acute Tox. 3 Oral Carc. 2 Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |