홈MCP워크벤치Skills
홈워크벤치알림마이페이지
llms.txt · MCP 가이드개인정보처리방침 · 이용약관 · 지원v1.8.0
  1. 홈
  2. /반응

Trifluoroacetic acid → Ethyl 3-[2-(1-isopropylcarbamoyl-piperidin-4-yl)-ethoxy]-benzoate

HRID 391208
노트
인쇄 미리보기

반응식

HRID 391208 반응식
[NH:1]1[CH2:6][CH2:5][CH:4]([CH2:7][CH2:8][O:9][C:10]2[CH:11]=[C:12]([CH:18]=[CH:19][CH:20]=2)[C:13]([O:15][CH2:16][CH3:17])=[O:14])[CH2:3][CH2:2]1.C(O)(C(F)(F)F)=O.CCN(C(C)C)C(C)C.[CH:37]([N:40]=[C:41]=[O:42])([CH3:39])[CH3:38]>C(Cl)Cl>[CH:37]([NH:40][C:41]([N:1]1[CH2:2][CH2:3][CH:4]([CH2:7][CH2:8][O:9][C:10]2[CH:11]=[C:12]([CH:18]=[CH:19][CH:20]=2)[C:13]([O:15][CH2:16][CH3:17])=[O:14])[CH2:5][CH2:6]1)=[O:42])([CH3:39])[CH3:38]
참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트

참가 물질

6

반응물 4

HCID 6422Trifluoroacetic acidHCID 61277Isopropyl isocyanateHCID 81531DiisopropylethylamineHCID 56830235Ethyl 3-(2-piperidin-4-yl-ethoxy)-benzoate

생성물 1

HCID 66929612Ethyl 3-[2-(1-isopropylcarbamoyl-piperidin-4-yl)-ethoxy]-benzoate

시약·촉매·용매 1

HCID 6344
Dichloromethane
용매

반응 조건

온도
20 °C

실험 절차

Ethyl 3-(2-piperidin-4-yl-ethoxy)-benzoate (1.0 g of the TFA salt, 2.6 mmol) was dissolved in DCM (10 ml), were upon DIPEA (1.3 ml, 7.7 mmol) and isopropyl isocyanate (0.33 g, 3.8 mmol) was added. The reaction mixture was shaken overnight at 20° C. Silica gel (10 ml) was added, and the solvent removed in vacuo. Flash chromatography (EtOAc/heptan 35:65 □ 55:45) provided 0.67 g of the title compound. LC-MS (m/z): 364 (M+2).

후처리

  1. additionwas added
  2. additionSilica gel (10 ml) was added
  3. customthe solvent removed in vacuo

출처 및 근거

ORD 기록
ord-dd121ffdd6464977a00d418cadb0c1a3
출처 데이터셋
uspto-grants-2013_02
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08383820B2

반응 노트

불러오는 중…

이 페이지에서참가 물질반응 조건실험 절차후처리출처 및 근거반응 노트