Benzyl {[2-nitro-4-(methylsulfonyl)phenyl]sulfanyl}acetate
benzyl 2-(4-methylsulfonyl-2-nitrophenyl)sulfanylacetate
Also Known As: AS-871/41415373|SR-01000259400-1|benzyl 2-(4-methylsulfonyl-2-nitrophenyl)sulfanylacetate|benzyl {[2-nitro-4-(methylsulfonyl)phenyl]sulfanyl}acetate|benzyl 2-((4-(methylsulfonyl)-2-nitrophenyl)thio)acetate|phenylmethyl 2-[4-(methylsulfonyl)-2-nitrophenylthio]acetate
CAS: 526189-75-3
| Molecular Formula | C16H15NO6S2 |
|---|---|
| Molecular Weight | 381.0341 g/mol |
| LogP | 2.8338 |
| Topological Polar Surface Area | 103.58 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 381.0341 |
| Monoisotopic Mass | 381.0341 |
| Heavy Atoms | 25 |
| Complexity | 880.75287 |
Chemical Identifiers
| CAS Number | 526189-75-3 |
|---|---|
| SMILES | CS(=O)(=O)C1=CC(=C(C=C1)SCC(=O)OCC2=CC=CC=C2)[N+](=O)[O-] |
Product Overview
Benzyl {[2-nitro-4-(methylsulfonyl)phenyl]sulfanyl}acetate (CAS 526189-75-3), with molecular formula C16H15NO6S2 and molecular weight 381.0341 g/mol. IUPAC: benzyl 2-(4-methylsulfonyl-2-nitrophenyl)sulfanylacetate.
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.
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Benzyl {[2-nitro-4-(methylsulfonyl)phenyl]sulfanyl}acetate is a custom synthesis product. We offer services from milligram to kilogram scale.
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