
6602-28-4
| Name | 3-Pyridinol N-oxide |
| CAS | 6602-28-4 |
| EINECS(EC#) | 229-545-4 |
| Molecular Formula | C5H5NO2 |
| MDL Number | MFCD00006200 |
| Molecular Weight | 111.1 |
| MOL File | 6602-28-4.mol |
Chemical Properties
| Appearance | light yellow to beige fine crystalline powder |
| Melting point | 190-192 °C(lit.) |
| Boiling point | 208.19°C (rough estimate) |
| density | 1.3113 (rough estimate) |
| refractive index | 1.4260 (estimate) |
| form | powder to crystal |
| pka | 8.07±0.10(Predicted) |
| color | White to Yellow to Orange |
| InChI | InChI=1S/C5H5NO2/c7-5-2-1-3-6(8)4-5/h1-4,7H |
| InChIKey | YMEZKRMAPQIBQH-UHFFFAOYSA-N |
| SMILES | C1[N+]([O-])=CC=CC=1O |
| CAS DataBase Reference | 6602-28-4(CAS DataBase Reference) |
| NIST Chemistry Reference | Pyridinium,1,3-dihydroxy-,1-hydroxide,inner salt(6602-28-4) |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| RTECS | UU7719100 |
| HS Code | 29333999 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral Carc. 2 Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |