AC1NY5OP
3-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]propanoic acid
Also Known As: BAS 02323341|3-[5-(3,4-dimethoxyphenyl)-3-hydroxy-2-oxo-4-(phenylcarbonyl)-3-pyrrolinyl]pro panoic acid|3-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]propanoic acid
CAS: 339335-35-2
| Molecular Formula | C22H21NO7 |
|---|---|
| Molecular Weight | 411.1318 g/mol |
| LogP | 2.6002 |
| Topological Polar Surface Area | 113.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 411.1318 |
| Monoisotopic Mass | 411.1318 |
| Heavy Atoms | 30 |
| Complexity | 1013.40106 |
Chemical Identifiers
| CAS Number | 339335-35-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2CCC(=O)O)OC |
Product Overview
AC1NY5OP (CAS 339335-35-2), with molecular formula C22H21NO7 and molecular weight 411.1318 g/mol. IUPAC: 3-[(3E)-2-(3,4-dimethoxyphenyl)-3-[hydroxy(phenyl)methylidene]-4,5-dioxopyrrolidin-1-yl]propanoic acid.
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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