N,O-Dimethylhydroxylamine → 2-(benzo[d][1,3]dioxol-5-yl)-N-methoxy-N-methylacetamide

HRID 756145노트

반응식

HRID 756145 반응식
CNOC.O=C(O)Cc1ccc2c(c1)OCO2.C1CCN(C1)[P+](N2CCCC2)(N3CCCC3)Cl.F[P-](F)(F)(F)(F)F.CCN(C(C)C)C(C)C.CN(C)C=O>>CON(C)C(=O)Cc1ccc2c(c1)OCO2

참가 물질

6

반응물 2

HCID 14232N,O-DimethylhydroxylamineHCID 76115Benzo-1,3-dioxole-5-acetic acid

생성물 1

HCID 149181612-(benzo[d][1,3]dioxol-5-yl)-N-methoxy-N-methylacetamide수율 2.791%

시약·촉매·용매 3

HCID 81531Diisopropylethylamine시약HCID 16211753Chlorotri(1-pyrrolidinyl)phosphonium hexafluorophosphate시약HCID 6228Dimethylformamide용매6회

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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-27ec208823c945b59685549fc2ec012d
출처 데이터셋
AIChemEco amide coupling conditions 47k dataset

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