3-(4-Methylbenzene-1-sulfonyl)-1-(4-nitrophenyl)propan-1-one
3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)propan-1-one
Also Known As: 3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)propan-1-one|3-(4-Methylbenzene-1-sulfonyl)-1-(4-nitrophenyl)propan-1-one
CAS: 87015-39-2
| Molecular Formula | C16H15NO5S |
|---|---|
| Molecular Weight | 333.0671 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 333.0671 |
| Monoisotopic Mass | 333.0671 |
| Heavy Atoms | 23 |
| Complexity | 518.0 |
Chemical Identifiers
| CAS Number | 87015-39-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)CCC(=O)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | UQNDQOZATOSTCE-UHFFFAOYSA-N |
Product Overview
3-(4-Methylbenzene-1-sulfonyl)-1-(4-nitrophenyl)propan-1-one (CAS 87015-39-2), with molecular formula C16H15NO5S and molecular weight 333.0671 g/mol. IUPAC: 3-(4-methylphenyl)sulfonyl-1-(4-nitrophenyl)propan-1-one.
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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