5470-66-6
| Name | 4-Nitro-2-picoline N-oxide |
| CAS | 5470-66-6 |
| EINECS(EC#) | 628-037-3 |
| Molecular Formula | C6H6N2O3 |
| MDL Number | MFCD00014625 |
| Molecular Weight | 154.12 |
| MOL File | 5470-66-6.mol |
Chemical Properties
| Appearance | Yellow Solid |
| Melting point | 155-159 °C(lit.) |
| Boiling point | 277.46°C (rough estimate) |
| density | 1.4564 (rough estimate) |
| refractive index | 1.5100 (estimate) |
| storage temp. | 2-8°C |
| solubility | DMSO, Methanol |
| form | powder |
| pka | -1.18±0.10(Predicted) |
| color | yellow to light orange |
| λmax | 333nm(EtOH)(lit.) |
| Detection Methods | HPLC,NMR |
| BRN | 135501 |
| InChI | InChI=1S/C6H6N2O3/c1-5-4-6(8(10)11)2-3-7(5)9/h2-4H,1H3 |
| InChIKey | FTTIAVRPJGCXAC-UHFFFAOYSA-N |
| SMILES | C1(C)[N+]([O-])=CC=C([N+]([O-])=O)C=1 |
| CAS DataBase Reference | 5470-66-6(CAS DataBase Reference) |
| NIST Chemistry Reference | 4-Nitro-2-picoline-n-oxide(5470-66-6) |
Safety Data
| Symbol(GHS) |   GHS07,GHS08 |
| Signal word | Warning |
| Hazard statements | H302+H312+H332-H315-H319-H335-H351 |
| Precautionary statements | P280-P301+P312-P302+P352+P312-P304+P340+P312-P305+P351+P338-P308+P313 |
| Hazard Codes | Xn,Xi |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 2811 |
| WGK Germany | 3 |
| RTECS | UT5710000 |
| HazardClass | 6.1 |
| PackingGroup | III |
| HS Code | 29333990 |
| 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 |
