1-(4-Bromophenyl)pentane-1,4-dione
1-(4-bromophenyl)pentane-1,4-dione
Also Known As: 1-(4-bromophenyl)pentane-1,4-dione|2-Butanone, 3-[4-bromobenzoyl]-|1-(4-Bromophenyl)-1,4-pentanedione|1-(4'-bromophenyl)-pentane-1,4-dione|1-(4-Bromophenyl)-1,4-pentanedione #|J1.430.446K
CAS: 2108-56-7
| Molecular Formula | C11H11BrO2 |
|---|---|
| Molecular Weight | 253.99425 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 253.99425 |
| Monoisotopic Mass | 253.99425 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 2108-56-7 |
|---|---|
| SMILES | CC(=O)CCC(=O)C1=CC=C(C=C1)Br |
| InChIKey | WQHAUGRATDZWJB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (10 patents)
Organic Building Blocks (10 patents)
Pharmaceutical Intermediates (6 patents)
Product Overview
1-(4-Bromophenyl)pentane-1,4-dione (CAS 2108-56-7), with molecular formula C11H11BrO2 and molecular weight 253.99425 g/mol. IUPAC: 1-(4-bromophenyl)pentane-1,4-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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