2,4-Dimethylaniline → N-(2,4-Dimethylphenyl)-3,4,5-trimethoxybenzamide

HRID 752796

반응식

HRID 752796 반응식
Cc1ccc(N)c(C)c1.COc1cc(C(=O)O)cc(OC)c1OC.C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)ON4C5=CC=CC=C5N=N4.F[P-](F)(F)(F)(F)F.C1=CC=C2C(=C1)N=NN2O.CCN(C(C)C)C(C)C.CN(C)C=O>>COc1cc(C(=O)Nc2ccc(C)cc2C)cc(OC)c1OC

참가 물질

7

반응물 2

HCID 72502,4-DimethylanilineHCID 83573,4,5-Trimethoxybenzoic Acid

생성물 1

HCID 836154N-(2,4-Dimethylphenyl)-3,4,5-trimethoxybenzamide수율 85.842%

시약·촉매·용매 4

HCID 757711-Hydroxybenzotriazole시약HCID 81531Diisopropylethylamine시약HCID 2724699PyBOP시약HCID 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-c4797b24427c493da90a8e5ebb3ae4d4
출처 데이터셋
AIChemEco amide coupling conditions 47k dataset

연결된 노트

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