AC1NA2U3
methyl 2-[[2-(4-ethoxyphenyl)-4,5-dimethoxy-3-oxo-1H-isoindol-1-yl]sulfanyl]acetate
Also Known As: methyl 2-((2-(4-ethoxyphenyl)-4,5-dimethoxy-3-oxoisoindolin-1-yl)thio)acetate|methyl 2-[[2-(4-ethoxyphenyl)-4,5-dimethoxy-3-oxo-1H-isoindol-1-yl]sulfanyl]acetate|methyl {[2-(4-ethoxyphenyl)-4,5-dimethoxy-3-oxo-2,3-dihydro-1H-isoindol-1-yl]sulfanyl}acetate
CAS: 369403-33-8
| Molecular Formula | C21H23NO6S |
|---|---|
| Molecular Weight | 417.1246 g/mol |
| LogP | 3.6677 |
| Topological Polar Surface Area | 74.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 417.1246 |
| Monoisotopic Mass | 417.1246 |
| Heavy Atoms | 29 |
| Complexity | 898.7895 |
Chemical Identifiers
| CAS Number | 369403-33-8 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)N2C(C3=C(C2=O)C(=C(C=C3)OC)OC)SCC(=O)OC |
Product Overview
AC1NA2U3 (CAS 369403-33-8), with molecular formula C21H23NO6S and molecular weight 417.1246 g/mol. IUPAC: methyl 2-[[2-(4-ethoxyphenyl)-4,5-dimethoxy-3-oxo-1H-isoindol-1-yl]sulfanyl]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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