HCID 15295804, compound → HCID 178439884, compound

HRID 2059460Notes

Reaction equation

HRID 2059460 reaction equation
CCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1Cc1ccc(-c2ccccc2C=O)cc1.CCSC(=O)C(F)C(=O)O>NCc1ccccc1.O=C(O)C(F)(F)F.CN(C)c1ccncc1.CN(C)C=O>CCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1Cc1ccc(-c2ccccc2/C=C(\F)C(=O)SCC)cc1

Participants

6

Reactant 2

HCID 15295804HCID 15295804, compoundHCID 178477510HCID 178477510, compound

Product 1

HCID 178439884HCID 178439884, compoundYield 95%

Reagents, catalysts & solvents 3

HCID 142844-(Dimethylamino)pyridineReagentHCID 12484433Benzenemethanamine, trifluoroacetateCatalystHCID 6228DimethylformamideSolvent

Conditions

Temperature
50 °C

Workup

  1. temperatureThe product mixture was cooled to 25 °C.
  2. filtrationFiltered through a pad of celite · Keep Organic
  3. wash"The celite was washed with ethyl acetate (3 x 1 mL)."
  4. concentrationThe filtrate was concentrated under reduced pressure
  5. additionA 0.07 M stock solution of the internal standard ethylene carbonate (0.70 mL in CDCl3) was added.

Sources & evidence

ORD record
ord-0d8fb70a0afa4a1eb34aacbf4c88ea12
Source dataset
Transfer learning optimization of 26 decarboxylative olefination reactions

Reaction notes

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