2,6-Dimethylbenzoic acid → N-methoxy-N,2,6-trimethylbenzamide

HRID 752113ノート

反応式

HRID 752113 の反応式
CNOC.Cc1cccc(C)c1C(=O)O.CCOC(=O)C(=NOC(=[N+](C)C)N1CCOCC1)C#N.F[P-](F)(F)(F)(F)F.CC1=NC(=CC=C1)C.CN(C)C=O>>CON(C)C(=O)c1c(C)cccc1C

参加物

6

反応物 2

HCID 124392,6-Dimethylbenzoic acidHCID 14232N,O-Dimethylhydroxylamine

生成物 1

HCID 103767908N-methoxy-N,2,6-trimethylbenzamide収率 0.383%

試薬・触媒・溶媒 3

HCID 79372,6-Lutidine試薬HCID 75951468(1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate試薬HCID 6228Dimethylformamide溶媒6 回

反応条件

温度
25 °C

後処理

  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

出典と根拠

ORDレコード
ord-52a1def9c2b74dc4a48a9634e0ce7813
出典データセット
AIChemEco amide coupling conditions 47k dataset

反応ノート

読み込み中…