5-(4-Nitrophenyl)cyclohexane-1,3-dione
5-(4-nitrophenyl)cyclohexane-1,3-dione
Also Known As: 5-(4-nitrophenyl)cyclohexane-1,3-dione|5575AE|5-(4-Nitrophenyl)-1,3-cyclohexanedione|1,3-Cyclohexanedione, 5-(4-nitrophenyl)-|1,3-Cyclohexanedione, 5-[4-nitrophenyl]-|5-(4-nitro-phenyl)-cyclohexane-1,3-dione|5-(4-Nitrophenyl)-1,3-cyclohexanedione #|Z-1969
CAS: 55579-75-4
| Molecular Formula | C12H11NO4 |
|---|---|
| Molecular Weight | 233.0688 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 80.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 233.0688 |
| Monoisotopic Mass | 233.0688 |
| Heavy Atoms | 17 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 55579-75-4 |
|---|---|
| SMILES | C1C(CC(=O)CC1=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | LQMGHIOOSOQCQA-UHFFFAOYSA-N |
Product Overview
5-(4-Nitrophenyl)cyclohexane-1,3-dione (CAS 55579-75-4), with molecular formula C12H11NO4 and molecular weight 233.0688 g/mol. IUPAC: 5-(4-nitrophenyl)cyclohexane-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.
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