3-Acetyl-2,4-dimethylpyrrole
- Product Name3-Acetyl-2,4-dimethylpyrrole
- CAS2386-25-6
- CBNumberCB7753619
- MFC8H11NO
- MW137.18
- EINECS219-197-1
- MDL NumberMFCD00005221
- MOL File2386-25-6.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 136-139 °C(lit.) |
| Boiling point | 173°C/12mmHg(lit.) |
| Density | 1.0630 (rough estimate) |
| refractive index | 1.5470 (estimate) |
| storage temp. | 2-8°C |
| solubility | soluble in Methanol |
| form | Powder or Crystals |
| pka | 16.40±0.50(Predicted) |
| color | Light yellow to pink to purple to brown |
| λmax | 282nm(EtOH)(lit.) |
| InChI | 1S/C8H11NO/c1-5-4-9-6(2)8(5)7(3)10/h4,9H,1-3H3 |
| InChIKey | VGZCKCJMYREIKA-UHFFFAOYSA-N |
| SMILES | CC(=O)c1c(C)c[nH]c1C |
| CAS DataBase Reference | 2386-25-6(CAS DataBase Reference) |
| EWG's Food Scores | 1 |
| NIST Chemistry Reference | Ethanone, 1-(2,4-dimethyl-1h-pyrrol-3-yl)-(2386-25-6) |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Symbol(GHS) |
|
|||||||||
| Signal word | Warning | |||||||||
| Hazard statements | H315-H319-H335 | |||||||||
| Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 | |||||||||
| Hazard Codes | Xi | |||||||||
| Risk Statements | 36/37/38 | |||||||||
| Safety Statements | 26-36-24/25 | |||||||||
| WGK Germany | 3 | |||||||||
| RTECS | OB2885000 | |||||||||
| HS Code | 29339980 | |||||||||
| Storage Class | 11 - Combustible Solids | |||||||||
| Hazard Classifications | Eye Irrit. 2 Skin Irrit. 2 STOT SE 3 | |||||||||
| NFPA 704: |
|
