2,4,6-Cycloheptatrien-1-one, 2-hydroxy-5-nitro-
2-hydroxy-5-nitrocyclohepta-2,4,6-trien-1-one
Also Known As: 5-Nitrotropolon|5-nitrotropolone|2-hydroxy-5-nitrocyclohepta-2,4,6-trien-1-one|BAS 01280713|2,4,6-Cycloheptatrien-1-one, 2-hydroxy-5-nitro-|2-hydroxy-5-nitrocyclohepta-2,4,6-trienone|J1.213.220D|2-Hydroxy-5-nitro-cyclohepta-2,4,6-trienone|2-Hydroxy-5-nitro-2,4,6-cycloheptatriene-1-one
| Molecular Formula | C7H5NO4 |
|---|---|
| Molecular Weight | 167.02185 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 83.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 167.02185 |
| Monoisotopic Mass | 167.02185 |
| Heavy Atoms | 12 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 3084-13-7 |
|---|---|
| SMILES | C1=CC(=O)C(=CC=C1[N+](=O)[O-])O |
| InChIKey | FDKIMQPNTGQYPT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,4,6-Cycloheptatrien-1-one, 2-hydroxy-5-nitro- (CAS 3084-13-7), with molecular formula C7H5NO4 and molecular weight 167.02185 g/mol. IUPAC: 2-hydroxy-5-nitrocyclohepta-2,4,6-trien-1-one.
2,4,6-Cycloheptatrien-1-one, 2-hydroxy-5-nitro- is a custom synthesis product. We offer services from milligram to kilogram scale.
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