AC1MC66G
[[5-chloro-3-(trifluoromethyl)-2-pyridinyl]-methyl-λ4-sulfanylidene]azanium;2,4,6-trimethylbenzenesulfonate
Also Known As: S-[5-Chloro-3-(trifluoromethyl)pyrid-2-yl]-S-methylsulfilimine 2,4,6-trimethylbenzenesulfonate|[[5-chloro-3-(trifluoromethyl)pyridin-2-yl]-methyl-|5-CHLORO-2-(METHYLSULFINOIMIDOYL)-3-(TRIFLUOROMETHYL)PYRIDINE 2,4,6-TRIMETHYLBENZENESULFONATE|s-[5-chloro-3-(trifluoromethyl)pyridin-2-yl]-s-methylsulphilimine 2,4,6-trimethylbenzenesulphonate|[[5-chloro-3-(trifluoromethyl)pyridin-2-yl]-methyl-lambda4-sulfanylidene]azanium;2,4,6-trimethylbenzenesulfonate
| Molecular Formula | C16H18ClF3N2O3S2 |
|---|---|
| Molecular Weight | 442.03995 g/mol |
| LogP | 2.81946 |
| Topological Polar Surface Area | 95.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 442.03995 |
| Monoisotopic Mass | 442.03995 |
| Heavy Atoms | 27 |
| Complexity | 954.35626 |
Chemical Identifiers
| CAS Number | 175203-07-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C)S(=O)(=O)[O-])C.CS(=[NH2+])C1=C(C=C(C=N1)Cl)C(F)(F)F |
Product Overview
AC1MC66G (CAS 175203-07-3), with molecular formula C16H18ClF3N2O3S2 and molecular weight 442.03995 g/mol. IUPAC: [[5-chloro-3-(trifluoromethyl)-2-pyridinyl]-methyl-λ4-sulfanylidene]azanium;2,4,6-trimethylbenzenesulfonate.
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