HCID 15295804, compound → HCID 178439884, compound

HRID 2059459Notes

Reaction equation

HRID 2059459 reaction equation
CCCc1nc2c(C)cc(-c3nc4ccccc4n3C)cc2n1Cc1ccc(-c2ccccc2C=O)cc1.CCSC(=O)C(F)C(=O)O>C1CCNC1.CN(C)c1ccncc1.C1CCOC1>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 100%

Reagents, catalysts & solvents 3

HCID 142844-(Dimethylamino)pyridineReagentHCID 31268PyrrolidineCatalystHCID 8028TetrahydrofuranSolvent

Conditions

Temperature
25 °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-2207869582e948eeb950304adb0b65ac
Source dataset
Transfer learning optimization of 26 decarboxylative olefination reactions

Reaction notes

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