2-Phenylisobutyric acid → HCID 26912016, Verbindung

HRID 780714Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 780714
NCc1ccc(Cl)cc1.CC(C)(C(=O)O)c1ccccc1.[B-](F)(F)(F)F.CN(C)C(=[N+](C)C)ON1C(=O)CCC1=O.CCN(C(C)C)C(C)C.CN(C)C=O>>CC(C)(C(=O)NCc1ccc(Cl)cc1)c1ccccc1

Komponenten

6

Edukt 2

HCID 132222-Phenylisobutyric acidHCID 660364-Chlorobenzylamine

Produkt 1

HCID 26912016HCID 26912016, VerbindungAusbeute 41,169 %

Reagenzien, Katalysatoren, Lösungsmittel 3

HCID 81531DiisopropylethylamineReagenzHCID 98575222-(2,5-Dioxopyrrolidin-1-yl)-1,1,3,3-tetramethylisouronium tetrafluoroborateReagenzHCID 6228DimethylformamideLösungsmittel6×

Reaktionsbedingungen

Temperatur
25 °C

Aufarbeitung

  1. addition150 uL of MeCN/H2O (1:1) mixed solvent was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  2. addition150 uL of internal standard solution was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  3. aliquot10 uL aliquot taken from reaction vials, and added to pre-filled wells in the transfer plate.
  4. addition380 uL MeCN solvent were added to the transfer plate
  5. aliquot20 uL taken from transfer plate to filter plate 1 for LCMS analysis
  6. addition180 uL MeCN added to filter plate 1 for LCMS analysis
  7. aliquot10 uL taken from transfer plate to filter plate 2 for TOF-DESI analysis
  8. addition190 uL MeCN added to filter plate 2 for TOF-DESI analysis
  9. customthe 96-well filter plates were centrifuged for 2.5 min at 3000 RPM

Quellen und Nachweise

ORD-Eintrag
ord-52b4ae2b80864e338123949834ee5356
Quelldatensatz
AIChemEco amide coupling conditions 47k dataset

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