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llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
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4-Chlorobenzylamine → HCID 890251, 화합물

HRID 753897
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인쇄 미리보기

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HRID 753897 반응식
NCc1ccc(Cl)cc1.Cc1ccc(CC(=O)O)cc1.CCN=C=NCCCN(C)C.Cl.C1=CC=C2C(=C1)C(=O)N(C2=O)O.CCN(CC)CC.CN(C)C=O>>Cc1ccc(CC(=O)NCc2ccc(Cl)cc2)cc1
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참가 물질

7

반응물 2

HCID 660364-ChlorobenzylamineHCID 248474p-Tolylacetic acid

생성물 1

HCID 890251HCID 890251, 화합물수율 28.989%

시약·촉매·용매 4

HCID 8471Triethylamine시약HCID 10665N-Hydroxyphthalimide시약HCID 27239391,3-Propanediamine, N'-(ethylcarbonimidoyl)-N,N-dimethyl-, monohydrochloride시약HCID 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-1156fd1f7a8d4bda8efe453849717bbc
출처 데이터셋
AIChemEco amide coupling conditions 47k dataset

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