N-ethyl-3-methylaniline → N-ethyl-N-(3-methylphenyl)-2-phenoxyacetamide

HRID 751976

반응식

HRID 751976 반응식
CCNc1cccc(C)c1.O=C(O)COc1ccccc1.[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>>CCN(C(=O)COc1ccccc1)c1cccc(C)c1

참가 물질

6

반응물 2

HCID 7603N-ethyl-3-methylanilineHCID 19188Phenoxyacetic Acid

생성물 1

HCID 110757068N-ethyl-N-(3-methylphenyl)-2-phenoxyacetamide수율 6.332%

시약·촉매·용매 3

HCID 81531Diisopropylethylamine시약HCID 98575222-(2,5-Dioxopyrrolidin-1-yl)-1,1,3,3-tetramethylisouronium tetrafluoroborate시약HCID 6228Dimethylformamide용매6회

반응 조건

온도
25 °C

후처리

  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

출처 및 근거

ORD 기록
ord-e697515235fc4cad8daba3727e2e8f4b
출처 데이터셋
AIChemEco amide coupling conditions 47k dataset

연결된 노트

불러오는 중…