(4-Nitrophenyl) 2-phenethyloxysulfinylbenzoate
(4-nitrophenyl) 2-(2-phenylethoxysulfinyl)benzoate
Also Known As: (4-nitrophenyl) 2-phenethyloxysulfinylbenzoate|(4-nitrophenyl) 2-(2-phenylethoxysulfinyl)benzoate|4-nitrophenyl 2-[(2-phenylethoxy)sulfinyl]benzoate
CAS: 40599-86-8
| Molecular Formula | C21H17NO6S |
|---|---|
| Molecular Weight | 411.07767 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 411.07767 |
| Monoisotopic Mass | 411.07767 |
| Heavy Atoms | 29 |
| Complexity | 566.0 |
Chemical Identifiers
| CAS Number | 40599-86-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCOS(=O)C2=CC=CC=C2C(=O)OC3=CC=C(C=C3)[N+](=O)[O-] |
| InChIKey | OUPVBQMFMJYNON-UHFFFAOYSA-N |
Product Overview
(4-Nitrophenyl) 2-phenethyloxysulfinylbenzoate (CAS 40599-86-8), with molecular formula C21H17NO6S and molecular weight 411.07767 g/mol. IUPAC: (4-nitrophenyl) 2-(2-phenylethoxysulfinyl)benzoate.
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 →
(4-Nitrophenyl) 2-phenethyloxysulfinylbenzoate is a custom synthesis product. We offer services from milligram to kilogram scale.
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