Structure of 18207-47-1
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The BI-3802 was designed by Boehringer Ingelheim and could be obtained free of charge through the Boehringer Ingelheim open innovation portal opnMe.com, associated with its negative control.
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CAS No. : | 18207-47-1 |
Formula : | C6H3F3O2 |
M.W : | 164.08 |
SMILES Code : | FC(F)(F)C(=O)C1=CC=CO1 |
MDL No. : | MFCD07380746 |
InChI Key : | MAZDPKNERLXXOV-UHFFFAOYSA-N |
Pubchem ID : | 140350 |
GHS Pictogram: |
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Signal Word: | Warning |
Hazard Statements: | H302-H315-H319-H335 |
Precautionary Statements: | P261-P305+P351+P338 |
* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.
Yield | Reaction Conditions | Operation in experiment |
---|---|---|
78% | With water; Dess-Martin periodane; In dichloromethane; at 20℃; for 3h; | To a solution of alcohol from above (2.6g) in CH2CI2 at room temperature was added Dess-Martin reagent (10G) portionwise and 1 drop of water. After stirring for 3hr at room temperature, 10% NA2S203 (60ML) was added and after stirring overnight, the solid was filtered off and the filtrate was extracted with CH2CI2. The organic layer was washed with saturated'sodium bicarbonate, dried with MGS04, filtered and concentrated in vacuo. Ether/hexane (1: 2; 30ML) was added to the residue, filtered, and filtrate concentrated in vacuo to give the product (2g, 78%). |
78% | To a solution of alcohol from above (2.6 g) in CH C12 at room temperature was added Dess-Martin reagent (10 g) portionwise and 1 drop of water. After stirring for 3 hr at room temperature, 10% Na2S2O3 (60 ml) was added and after stirring overnight, the solid was filtered off and the filtrate was extracted with CH2C12. The organic layer was washed with saturated sodium bicarbonate, dried with MgSO4, filtered and concentrated in vacuo. Ether/hexane (1:2; 30 ml) was added to the residue, filtered, and filtrate concentrated in vacuo to give the product (2 g, 78%). | |
78% | With Dess-Martin periodane; sodium sulfite; In dichloromethane; at 20℃; | To a solution of alcohol from above (2.6 g) in CH2Cl2 at room temperature was added Dess-Martin reagent (10 g) portionwise and 1 drop of water. After stirring for 3 hr at room temperature, 10% Na2S2O3 (60 ml) was added and after stirring overnight, the solid was filtered off and the filtrate was extracted with CH2Cl2. The organic layer was washed with saturated sodium bicarbonate, dried with MgSO4, filtered and concentrated in vacuo. Ether/hexane (1:2; 30 ml) was added to the residue, filtered, and filtrate concentrated in vacuo to give the product (2 g, 78%). |
78% | Step B; To a solution of alcohol from above (2.6g) in CH2CI2 at room temperature was added Dess-Martin reagent (10g) portionwise and 1 drop of water. After stirring for 3hr at room temperature, 10% Na2S203 (60ml) was added and after stirring overnight, the solid was filtered off and the filtrate was extracted with CH2CI2. The organic layer was washed with saturated sodium bicarbonate, dried with MgS04, filtered and concentrated in vacuo. Ether/hexane (1: 2; 30ml) was added to the residue, filtered, and filtrate concentrated in vacuo to give the product (2g, 78%). | |
78% | With water; Dess-Martin periodane; In dichloromethane; at 20℃; for 3h; | To a solution of alcohol from above (2.6g) in CH2CI2 at room temperature was added Dess-Martin reagent (10g) portionwise and 1 drop of water. After stirring for 3hr at room temperature, 10% Na2S203 (60ml) was added and after stirring overnight, the solid was filtered off and the filtrate was extracted with CH2CI2. The organic layer was washed with saturated sodium bicarbonate, dried with MgS04, filtered and concentrated in vacuo. Ether/hexane (1: 2; 30mut) was added to the residue, filtered, and filtrate concentrated in vacuo to give the product (2g, 78%). |
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