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

Hydrochloric Acid → HCID 58579503, 화합물

HRID 1662188
노트
인쇄 미리보기

반응식

HRID 1662188 반응식
C([Li])CCC.Br[C:7]1[CH:12]=[C:11]([CH3:13])[N:10]=[C:9]([CH:14]([F:16])[F:15])[CH:8]=1.[Cl:17][C:18]1[CH:23]=[C:22](/[C:24](/[C:32]2[CH:37]=[CH:36][CH:35]=[C:34]([F:38])[C:33]=2[C:39]#[N:40])=[N:25]\S(C(C)(C)C)=O)[CH:21]=[CH:20][N:19]=1.Cl.C(OCC)C>C1COCC1.CO>[Cl:17][C:18]1[CH:23]=[C:22]([C:24]2([C:7]3[CH:12]=[C:11]([CH3:13])[N:10]=[C:9]([CH:14]([F:16])[F:15])[CH:8]=3)[C:32]3[C:33](=[C:34]([F:38])[CH:35]=[CH:36][CH:37]=3)[C:39]([NH2:40])=[N:25]2)[CH:21]=[CH:20][N:19]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

8

반응물 5

HCID 313Hydrochloric AcidHCID 3283Diethyl EtherHCID 58579504HCID 58579504, 화합물HCID 593275464-Bromo-2-(difluoromethyl)-6-methylpyridineHCID 178418339Butyllithium

생성물 1

HCID 58579503HCID 58579503, 화합물수율 51%

시약·촉매·용매 2

HCID 887Methanol용매
HCID 8028Tetrahydrofuran용매2회

실험 절차

n-Butyllithium (1.174 mL, 2.94 mmol) was added to 4-bromo-2-(difluoromethyl)-6-methylpyridine (543 mg, 2.45 mmol) in THF (15 mL) at −78° C. under nitrogen atmosphere. The reaction was stirred for 30 min before (E)-N-((2-chloropyridin-4-yl)(2-cyano-3-fluorophenyl)methylene)-2-methylpropane-2-sulfinamide (890 mg, 2.45 mmol) in THF (5 mL) was added. The reaction was kept at −78° C. for 1 hour and then allowed to reach room temperature. MeOH (15 mL) was added followed by hydrochloric acid in diethylether (7.34 mL, 7.34 mmol) and the reaction was stirred for 1 hour. NaHCO3(sat) was added and the mixture was extracted with EtOAc (×2). The combined organic phases were dried and concentrated to give 0.5 g (51%) of the title compound, which was used without further purification. MS (ES+) m/z 403 [M+1]+.

후처리

  1. additionwas added
  2. customto reach room temperature
  3. extractionthe mixture was extracted with EtOAc (×2)
  4. customThe combined organic phases were dried
  5. concentrationconcentrated

출처 및 근거

ORD 기록
ord-101b91c5cbc3425297f3729fcdc7b3eb
출처 데이터셋
uspto-grants-2011_10
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08030500B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트