4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one
(E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one
Also Known As: 4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one|(E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one|(3E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)-3-buten-2-one
CAS: 892148-77-5
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.09972 g/mol |
| LogP | 2.23374 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 163.09972 |
| Monoisotopic Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 320.57962 |
Chemical Identifiers
| CAS Number | 892148-77-5 |
|---|---|
| SMILES | CC1=CC(=C(N1)C)/C=C/C(=O)C |
Product Overview
4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one (CAS 892148-77-5), with molecular formula C10H13NO and molecular weight 163.09972 g/mol. IUPAC: (E)-4-(2,5-dimethyl-1H-pyrrol-3-yl)but-3-en-2-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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