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

Acetic Anhydride → 1-(5-Bromopyridin-2-yl)piperidin-4-yl acetate

HRID 447303
노트
인쇄 미리보기

반응식

HRID 447303 반응식
[Br:1][C:2]1[CH:3]=[CH:4][C:5]([N:8]2[CH2:13][CH2:12][CH:11]([OH:14])[CH2:10][CH2:9]2)=[N:6][CH:7]=1.[C:15](OC(=O)C)(=[O:17])[CH3:16].CCN(CC)CC>CN(C1C=CN=CC=1)C.C(Cl)Cl.[Cl-].[Na+].O>[C:15]([O:14][CH:11]1[CH2:12][CH2:13][N:8]([C:5]2[CH:4]=[CH:3][C:2]([Br:1])=[CH:7][N:6]=2)[CH2:9][CH2:10]1)(=[O:17])[CH3:16]
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

7

반응물 3

HCID 7918Acetic AnhydrideHCID 8471TriethylamineHCID 218978371-(5-Bromopyridin-2-yl)piperidin-4-ol

생성물 1

HCID 667304631-(5-Bromopyridin-2-yl)piperidin-4-yl acetate

시약·촉매·용매 3

HCID 142844-(Dimethylamino)pyridine촉매HCID 6344Dichloromethane용매
HCID 57417360
Sodium chloride; water
용매

실험 절차

A mixture of 1-(5-bromopyridin-2-yl)piperidin-4-ol (200 mg, 0.78 mmol), acetic anhydride (0.16 mL, 1.7 mmol), DMAP (10 mg, 0.08 mmol), and Et3N (0.24 mL, 1.7 mmol) in CH2Cl2 (4 mL) was stirred at rt for 17 h. Brine was added and extracted with CH2Cl2, dried over MgSO4, filtered and concentrated to dryness. The crude product was triturated with water and the title compound was collected by vacuum filtration (203 mg, 88%). 1H NMR (400 MHz, CDCl3) δ 8.17 (d, J=2.2 Hz, 1H), 7.52 (dd, J=9.0 Hz, 2.5 Hz, 1H), 6.57 (d, 9.0 Hz, 1H), 5.01-4.95 (m, 1H), 3.9-3.85 (m, 2H), 3.35-3.28 (m, 2H), 2.07 (s, 3H), 1.99-1.92 (m, 2H), 1.74-1.65 (m, 2H); MS ESI 300.9 [M+H]+, calcd for [C12H15BrN2O2+H]+ 299.03.

후처리

  1. extractionextracted with CH2Cl2
  2. dry with materialdried over MgSO4
  3. filtrationfiltered
  4. concentrationconcentrated to dryness
  5. customThe crude product was triturated with water
  6. filtrationthe title compound was collected by vacuum filtration (203 mg, 88%)

출처 및 근거

ORD 기록
ord-67179bc1b37d4010b3f9a7269b4850d4
출처 데이터셋
uspto-grants-2013_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08481533B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트