1-(5-Acetyl-2-methoxy-phenyl)-3-methyl-butan-1-one
1-(5-acetyl-2-methoxyphenyl)-3-methylbutan-1-one
Also Known As: Espeletone|Espeleton|1-(5-acetyl-2-methoxyphenyl)-3-methyl-1-butanone|1-(5-acetyl-2-methoxyphenyl)-3-methylbutan-1-one|1-(5-acetyl-2-methoxy-phenyl)-3-methyl-butan-1-one|1-Butanone, 1-(5-acetyl-2-methoxyphenyl)-3-methyl-|1-(5-Acetyl -2-methoxyphenyl )-3-methyl -1-butanone
CAS: 51995-98-3
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.1256 g/mol |
| LogP | 3.1266 |
| Topological Polar Surface Area | 43.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 234.1256 |
| Monoisotopic Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 433.0935 |
Chemical Identifiers
| CAS Number | 51995-98-3 |
|---|---|
| SMILES | CC(C)CC(=O)C1=C(C=CC(=C1)C(=O)C)OC |
Product Overview
1-(5-Acetyl-2-methoxy-phenyl)-3-methyl-butan-1-one (CAS 51995-98-3), with molecular formula C14H18O3 and molecular weight 234.1256 g/mol. IUPAC: 1-(5-acetyl-2-methoxyphenyl)-3-methylbutan-1-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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