2-Methylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene
2-methylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene
Also Known As: (2,6-dinitro-4-(trifluoromethyl)phenyl)(methyl)sulfane|2-methylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene
CAS: 65516-76-9
| Molecular Formula | C8H5F3N2O4S |
|---|---|
| Molecular Weight | 281.99222 g/mol |
| LogP | 3.2437 |
| Topological Polar Surface Area | 86.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.99222 |
| Monoisotopic Mass | 281.99222 |
| Heavy Atoms | 18 |
| Complexity | 482.54892 |
Chemical Identifiers
| CAS Number | 65516-76-9 |
|---|---|
| SMILES | CSC1=C(C=C(C=C1[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-] |
Product Overview
2-Methylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene (CAS 65516-76-9), with molecular formula C8H5F3N2O4S and molecular weight 281.99222 g/mol. IUPAC: 2-methylsulfanyl-1,3-dinitro-5-(trifluoromethyl)benzene.
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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