5428-02-4
| Name | 2-NITRO-2-PHENYLPROPANE-1,3-DIOL |
| CAS | 5428-02-4 |
| EINECS(EC#) | 410-360-4 |
| Molecular Formula | C9H11NO4 |
| MDL Number | MFCD00218497 |
| Molecular Weight | 197.19 |
| MOL File | 5428-02-4.mol |
Chemical Properties
| Melting point | 100-102°C |
| Boiling point | 396.0±42.0 °C(Predicted) |
| density | 1.337±0.06 g/cm3(Predicted) |
| form | liquid |
| pka | 12.53±0.10(Predicted) |
| InChI | 1S/C9H11NO4/c11-6-9(7-12,10(13)14)8-4-2-1-3-5-8/h1-5,11-12H,6-7H2 |
| InChIKey | AJRYCRIQZBMNEO-UHFFFAOYSA-N |
| SMILES | [N+](=O)([O-])C(CO)(CO)c1ccccc1 |
Safety Data
| Hazard Codes | T,N |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 3077 |
| WGK Germany | WGK 3 |
| HazardClass | IRRITANT |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral Acute Tox. 4 Dermal Aquatic Chronic 2 |