1-(4'-Nitrophenyl)prop-2-en-1-one
1-(4-nitrophenyl)prop-2-en-1-one
Also Known As: NP-Peo|1-(4-nitrophenyl)prop-2-en-1-one|p-nitrophenylvinyl ketone|1- prop-2-en-1-one|1-(4'-Nitrophenyl)prop-2-en-1-one|2-Propen-1-one, 1-(4-nitrophenyl)-|1-(4-Nitrophenyl)-2-propen-1-one
CAS: 22731-72-2
| Molecular Formula | C9H7NO3 |
|---|---|
| Molecular Weight | 177.04259 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 177.04259 |
| Monoisotopic Mass | 177.04259 |
| Heavy Atoms | 13 |
| Complexity | 224.0 |
Chemical Identifiers
| CAS Number | 22731-72-2 |
|---|---|
| SMILES | C=CC(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | DQYLFLJHEBERCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (1 patents)
Biotechnology (4 patents)
Heterocyclic Building Blocks (7 patents)
Organic Building Blocks (1 patents)
Pharmaceutical Intermediates (10 patents)
Specialty Chemicals (2 patents)
Product Overview
1-(4'-Nitrophenyl)prop-2-en-1-one (CAS 22731-72-2), with molecular formula C9H7NO3 and molecular weight 177.04259 g/mol. IUPAC: 1-(4-nitrophenyl)prop-2-en-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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