19658-77-6
| Name | 1-IODOISOQUINOLINE |
| CAS | 19658-77-6 |
| Molecular Formula | C9H6IN |
| MDL Number | MFCD00234494 |
| Molecular Weight | 255.06 |
| MOL File | 19658-77-6.mol |
Chemical Properties
| Melting point | 72-76℃ |
| Boiling point | 336.8±15.0 °C(Predicted) |
| density | 1.837±0.06 g/cm3(Predicted) |
| storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
| solubility | soluble in Methanol |
| form | powder to crystal |
| pka | 2.27±0.30(Predicted) |
| color | Light yellow to Yellow to Green |
| InChI | 1S/C9H6IN/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H |
| InChIKey | FDDBUIWRNBGXHB-UHFFFAOYSA-N |
| SMILES | Ic1nccc2ccccc12 |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| RIDADR | UN 2811 6.1/PG 3 |
| WGK Germany | 3 |
| HS Code | 2933.49.7000 |
| Storage Class | 6.1C - Combustible acute toxic Cat.3 toxic compounds or compounds which causing chronic effects |
| Hazard Classifications | Acute Tox. 4 Oral Eye Dam. 1 Skin Irrit. 2 STOT SE 3 |