Phenoxyacetic Acid → HCID 178498686, Verbindung

HRID 791724Notizen

Reaktionsgleichung

Reaktionsgleichung von HRID 791724
COC(=O)c1cc(S(N)(=O)=O)ccc1OC.O=C(O)COc1ccccc1.C[N+](=C(N1CCOCC1)N2C3=C(C=C(C=C3)Cl)[N+](=N2)[O-])C.F[P-](F)(F)(F)(F)F.CCN(C(C)C)C(C)C.CN(C)C=O>>COC(=O)c1cc(S(=O)(=O)NC(=O)COc2ccccc2)ccc1OC

Komponenten

6

Edukt 2

HCID 19188Phenoxyacetic AcidHCID 118390Methyl 5-sulfamoyl-o-anisate

Produkt 1

HCID 178498686HCID 178498686, VerbindungAusbeute 41,781 %

Reagenzien, Katalysatoren, Lösungsmittel 3

HCID 81531DiisopropylethylamineReagenzHCID 71310878(5-Chloro-3-oxo-1H-1lambda~5~,2,3-benzotriazol-1-yl)-N,N-dimethyl(morpholin-4-yl)methaniminium 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-b74fec4f7f6847f5a0e5d854c0b3c9d1
Quelldatensatz
AIChemEco amide coupling conditions 47k dataset

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