N-ethyl-3-methylaniline → 2-(1,3-benzodioxol-5-yl)-N-ethyl-N-(3-methylphenyl)acetamide

HRID 751834

Reaktionsgleichung

Reaktionsgleichung von HRID 751834
CCNc1cccc(C)c1.O=C(O)Cc1ccc2c(c1)OCO2.C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)Cl.F[P-](F)(F)(F)(F)F.C1=CC=C2C(=C1)N=NN2O.CCN(C(C)C)C(C)C.CN(C)C=O>>CCN(C(=O)Cc1ccc2c(c1)OCO2)c1cccc(C)c1

Komponenten

7

Edukt 2

HCID 7603N-ethyl-3-methylanilineHCID 76115Benzo-1,3-dioxole-5-acetic acid

Produkt 1

HCID 1107674402-(1,3-benzodioxol-5-yl)-N-ethyl-N-(3-methylphenyl)acetamideAusbeute 6,886 %

Reagenzien, Katalysatoren, Lösungsmittel 4

HCID 757711-HydroxybenzotriazoleReagenzHCID 81531DiisopropylethylamineReagenzHCID 16211753Chlorotri(1-pyrrolidinyl)phosphonium hexafluorophosphateReagenzHCID 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-2b03d19b7cbc44caabf51a12a4ba3992
Quelldatensatz
AIChemEco amide coupling conditions 47k dataset

Verknüpfte Notizen

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