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| IUPAC Name: | trifluoromethanesulfonate;5-(trifluoromethyl)dibenzothiophen-5-ium |
| Description: | 5-(Trifluoromethyl)dibenzothiophenium trifluoromethanesulfonate (CAS# 129946-88-9) is used in the synthesis of substituted isoxazolines. Also used in the synthesis of β-ketophosphonate derivatives as building blocks in automated syntheses. |
| Molecular Weight: | 402.33 |
| Molecular Formula: | C14H8F6O3S2 |
| Canonical SMILES: | C1=CC=C2C(=C1)C3=CC=CC=C3[S+]2C(F)(F)F.C(F)(F)(F)S(=O)(=O)[O-] |
| InChI: | InChI=1S/C13H8F3S.CHF3O3S/c14-13(15,16)17-11-7-3-1-5-9(11)10-6-2-4-8-12(10)17;2-1(3,4)8(5,6)7/h1-8H;(H,5,6,7)/q+1;/p-1 |
| InChI Key: | QXXHXTRTGZBOGD-UHFFFAOYSA-M |
| Melting Point: | 150 °C |
| Purity: | 95 % |
| Density: | 7 g/cm3 |
| Appearance: | White to pale brown crystalline powder |
| Storage: | Keep in dark place, Inert atmosphere, Room temperature |
| MDL: | MFCD00236132 |
| LogP: | 5.35530 |
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Other Pyrimidines
N-[4-Cyclopropyl-6-(trifluoromethyl)pyrimidin-2-yl]propane-1,3-diamine
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