517-22-6
| Name | 2,4-Dimethyl-3-ethyl-1H-pyrrole |
| CAS | 517-22-6 |
| EINECS(EC#) | 208-234-7 |
| Molecular Formula | C8H13N |
| MDL Number | MFCD00005222 |
| Molecular Weight | 123.2 |
| MOL File | 517-22-6.mol |
Chemical Properties
| Appearance | clear yellow to red-brown liquid |
| Melting point | 63.75°C (estimate) |
| Boiling point | 197 °C/710 mmHg (lit.) |
| density | 0.913 g/mL at 25 °C(lit.) |
| refractive index | n |
| Fp | 161 °F |
| storage temp. | 0-6°C |
| solubility | Chloroform (Soluble), Methanol (Slightly) |
| form | Liquid |
| pka | 18.33±0.50(Predicted) |
| color | Clear yellow to red-brown |
| Specific Gravity | 0.913 |
| Detection Methods | GC,NMR |
| BRN | 107089 |
| InChI | 1S/C8H13N/c1-4-8-6(2)5-9-7(8)3/h5,9H,4H2,1-3H3 |
| InChIKey | ZEBBLOXDLGIMEG-UHFFFAOYSA-N |
| SMILES | CCc1c(C)c[nH]c1C |
| CAS DataBase Reference | 517-22-6(CAS DataBase Reference) |
| NIST Chemistry Reference | 1H-Pyrrole, 3-ethyl-2,4-dimethyl-(517-22-6) |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| RTECS | UX9629500 |
| HS Code | 29339900 |
| Storage Class | 10 - Combustible liquids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |