HCID 11263568, compound → HCID 178502706, compound

HRID 2059485Notes

Reaction equation

HRID 2059485 reaction equation
CON(C)C(=O)CC(=O)O.Cc1ccc(C)c(OCCCC(C)(C)C=O)c1>NCc1ccccc1.O=C(O)C(F)(F)F.CN(C)c1ccncc1.CN(C)C=O>CON(C)C(=O)/C=C/C(C)(C)CCCOc1cc(C)ccc1C

Participants

6

Reactant 2

HCID 11263568HCID 11263568, compoundHCID 222208795-(2,5-Dimethylphenoxy)-2,2-dimethylpentanal

Product 1

HCID 178502706HCID 178502706, compoundYield 19%

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-a803adfee0ff42609d5ef646be9265c2
Source dataset
Transfer learning optimization of 26 decarboxylative olefination reactions

Reaction notes

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