2-(4-Nitrobenzylidene)-1-tetralone
2-[(4-nitrophenyl)methylidene]-3,4-dihydronaphthalen-1-one
Also Known As: 2-(4-nitrobenzylidene)-1-tetralone|(2E)-2-[(4-nitrophenyl)methylidene]tetralin-1-one|2-[(4-nitrophenyl)methylidene]-3,4-dihydronaphthalen-1-one
CAS: 49545-72-4
| Molecular Formula | C17H13NO3 |
|---|---|
| Molecular Weight | 279.08954 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 279.08954 |
| Monoisotopic Mass | 279.08954 |
| Heavy Atoms | 21 |
| Complexity | 443.0 |
Chemical Identifiers
| CAS Number | 49545-72-4 |
|---|---|
| SMILES | C1CC(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C31 |
| InChIKey | WEBULUVFDZSBFP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (16 patents)
Pharmaceutical Intermediates (7 patents)
Product Overview
2-(4-Nitrobenzylidene)-1-tetralone (CAS 49545-72-4), with molecular formula C17H13NO3 and molecular weight 279.08954 g/mol. IUPAC: 2-[(4-nitrophenyl)methylidene]-3,4-dihydronaphthalen-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.
View MSDS →
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