2-Bromo-1-phenylbutane-1,3-dione
2-bromo-1-phenylbutane-1,3-dione
Also Known As: 2-bromo-1-phenylbutane-1,3-dione|1,3-Butanedione, 2-bromo-1-phenyl-|alpha-Bromo-beta-oxobutyrophenone|1,3-Butanedione,2-bromo-1-phenyl|1-Phenyl-2-bromo-1,3-butanedione|1-Phenyl-2-bromobutane-1,3-dione|J1.886.701J
CAS: 57626-33-2
| Molecular Formula | C10H9BrO2 |
|---|---|
| Molecular Weight | 239.97859 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 239.97859 |
| Monoisotopic Mass | 239.97859 |
| Heavy Atoms | 13 |
| Complexity | 207.0 |
Chemical Identifiers
| CAS Number | 57626-33-2 |
|---|---|
| SMILES | CC(=O)C(C(=O)C1=CC=CC=C1)Br |
| InChIKey | OHHOGWYNHFMXIF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (11 patents)
Pharmaceutical Intermediates (119 patents)
Product Overview
2-Bromo-1-phenylbutane-1,3-dione (CAS 57626-33-2), with molecular formula C10H9BrO2 and molecular weight 239.97859 g/mol. IUPAC: 2-bromo-1-phenylbutane-1,3-dione.
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.
View MSDS →
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