2386-28-9
| Name | 4-ACETYL-3,5-DIMETHYL-1H-PYRROLE-2-CARBOXYLIC ACID |
| CAS | 2386-28-9 |
| Molecular Formula | C9H11NO3 |
| MDL Number | MFCD00022374 |
| Molecular Weight | 181.19 |
| MOL File | 2386-28-9.mol |
Chemical Properties
| Melting point | 205-207 °C(lit.) |
| Boiling point | 396.7±42.0 °C(Predicted) |
| density | 1?+-.0.06 g/cm3(Predicted) |
| storage temp. | Storage temp. 2-8°C |
| form | powder |
| pka | 4.71±0.50(Predicted) |
| Appearance | Off-white to light brown Solid |
| InChI | 1S/C9H11NO3/c1-4-7(6(3)11)5(2)10-8(4)9(12)13/h10H,1-3H3,(H,12,13) |
| InChIKey | SQFWNYAZHOVSPA-UHFFFAOYSA-N |
| SMILES | CC(=O)c1c(C)[nH]c(C(O)=O)c1C |
Safety Data
| Symbol(GHS) |  GHS07 |
| Signal word | Warning |
| Hazard statements | H315-H319-H335 |
| Precautionary statements | P261-P305+P351+P338 |
| Hazard Codes | Xi |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| HazardClass | IRRITANT |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 |