1-(4-Bromo-3-nitrophenyl)sulfinyl-2,4-dinitrobenzene
1-(4-bromo-3-nitrophenyl)sulfinyl-2,4-dinitrobenzene
Also Known As: 1-(4-bromo-3-nitrophenyl)sulfinyl-2,4-dinitrobenzene|(4-Brom-3-nitrophenyl)-(2,4-dinitrophenyl)-sulfoxid|1-(4-Bromo-3-nitrobenzene-1-sulfinyl)-2,4-dinitrobenzene
CAS: 1046-75-9
| Molecular Formula | C12H6BrN3O7S |
|---|---|
| Molecular Weight | 414.91098 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 174.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 414.91098 |
| Monoisotopic Mass | 414.91098 |
| Heavy Atoms | 24 |
| Complexity | 546.0 |
Chemical Identifiers
| CAS Number | 1046-75-9 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])S(=O)C2=CC(=C(C=C2)Br)[N+](=O)[O-] |
| InChIKey | SRTXXDIJSMABPZ-UHFFFAOYSA-N |
Product Overview
1-(4-Bromo-3-nitrophenyl)sulfinyl-2,4-dinitrobenzene (CAS 1046-75-9), with molecular formula C12H6BrN3O7S and molecular weight 414.91098 g/mol. IUPAC: 1-(4-bromo-3-nitrophenyl)sulfinyl-2,4-dinitrobenzene.
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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