696-40-2
| Name | 3-Iodobenzylamine |
| CAS | 696-40-2 |
| EINECS(EC#) | 625-616-2 |
| Molecular Formula | C7H8IN |
| MDL Number | MFCD00192227 |
| Molecular Weight | 233.05 |
| MOL File | 696-40-2.mol |
Chemical Properties
| Appearance | clear light yellow liquid |
| Melting point | 248-249 °C(Solv: N,N-dimethylformamide (68-12-2)) |
| Boiling point | 132 °C/8 mmHg (lit.) |
| density | 1.748 g/mL at 25 °C(lit.) |
| refractive index | 1.638-1.64 |
| Fp | >230 °F |
| storage temp. | under inert gas (nitrogen or Argon) at 2–8 °C |
| form | Liquid |
| pka | 8.79±0.10(Predicted) |
| color | Clear light yellow |
| Water Solubility | Difficult to mix in water. |
| Sensitive | Air & Light Sensitive |
| BRN | 2689602 |
| InChI | InChI=1S/C7H8IN/c8-7-3-1-2-6(4-7)5-9/h1-4H,5,9H2 |
| InChIKey | LQLOGZQVKUNBRX-UHFFFAOYSA-N |
| SMILES | C1(CN)=CC=CC(I)=C1 |
| CAS DataBase Reference | 696-40-2(CAS DataBase Reference) |
Safety Data
| Symbol(GHS) |   GHS07,GHS08 |
| Signal word | Danger |
| Hazard statements | H315-H317-H319-H334-H335-H361 |
| Precautionary statements | P201-P280-P302+P352-P305+P351+P338-P308+P313 |
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| RIDADR | 2735 |
| WGK Germany | 3 |
| HazardClass | 8 |
| PackingGroup | II |
| HS Code | 29214990 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Repr. 2 Resp. Sens. 1 Skin Irrit. 2 Skin Sens. 1 STOT SE 3 |