(2-Nitro-3-phenylprop-2-enyl) acetate
(2-nitro-3-phenylprop-2-enyl) acetate
Also Known As: [(Z)-2-nitro-3-phenyl-prop-2-enyl] acetate|2-Propen-1-ol, 2-nitro-3-phenyl-, acetate (ester)
CAS: 3532-57-8
| Molecular Formula | C11H11NO4 |
|---|---|
| Molecular Weight | 221.0688 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.0688 |
| Monoisotopic Mass | 221.0688 |
| Heavy Atoms | 16 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 3532-57-8 |
|---|---|
| SMILES | CC(=O)OCC(=CC1=CC=CC=C1)[N+](=O)[O-] |
| InChIKey | ABUCXZPWLZXBBB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Agrochemicals (3 patents)
Organic Building Blocks (1 patents)
Product Overview
(2-Nitro-3-phenylprop-2-enyl) acetate (CAS 3532-57-8), with molecular formula C11H11NO4 and molecular weight 221.0688 g/mol. IUPAC: (2-nitro-3-phenylprop-2-enyl) acetate.
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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