40598-94-5
| Name | 3-Bromoindazole |
| CAS | 40598-94-5 |
| Molecular Formula | C7H5BrN2 |
| MDL Number | MFCD00159926 |
| Molecular Weight | 197.03 |
| MOL File | 40598-94-5.mol |
Chemical Properties
| Melting point | 143-147 °C |
| Boiling point | 333.8±15.0 °C(Predicted) |
| density | 1.770±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2-8°C |
| form | solid |
| pka | 11.82±0.40(Predicted) |
| Appearance | White to off-white Solid |
| Detection Methods | HPLC |
| InChI | 1S/C7H5BrN2/c8-7-5-3-1-2-4-6(5)9-10-7/h1-4H,(H,9,10) |
| InChIKey | HTKXRTUKPXEALT-UHFFFAOYSA-N |
| SMILES | Brc1n[nH]c2ccccc12 |
| CAS DataBase Reference | 40598-94-5(CAS DataBase Reference) |
Safety Data
| Hazard Codes | T |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 2811 6.1/PG 3 |
| WGK Germany | 3 |
| HazardClass | 6.1 |
| PackingGroup | Ⅲ |
| HS Code | 29349990 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 3 Oral Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |
