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

Hydrochloric Acid → 7-Bromo-benzo[d]isothiazol-5-ylamine

HRID 389470
노트
인쇄 미리보기

반응식

HRID 389470 반응식
[Br:1][C:2]1[C:10]2[S:9][N:8]=[CH:7][C:6]=2[CH:5]=[C:4]([N+:11]([O-])=O)[CH:3]=1.Cl>C(O)C.[Fe]>[Br:1][C:2]1[C:10]2[S:9][N:8]=[CH:7][C:6]=2[CH:5]=[C:4]([NH2:11])[CH:3]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 2

HCID 313Hydrochloric AcidHCID 66759851HCID 66759851, 화합물

생성물 1

HCID 667606927-Bromo-benzo[d]isothiazol-5-ylamine수율 56%

시약·촉매·용매 2

HCID 23925Iron촉매HCID 702Ethanol용매

실험 절차

A mixture of 7-bromo-5-nitro-benzo[d]isothiazole (1.0 g, 3.9 mmol) and iron powder (1.0 g, 19 mmol) in ethanol (40 mL) was heated to reflux with vigorous stirring. An aqueous 0.1 N hydrochloric acid (10 mL, 1 mmol) solution was added and the reaction continued until TLC showed no starting material. The reaction mixture was cooled to RT and filtered. The filtrate was concentrated and aqueous sodium carbonate was added to the residue until it became basic. This mixture was filtered through Celite, washing with ethyl acetate. The organic layer was separated, washed with water, dried over anhydrous sodium sulfate and concentrated to give 500 mg (56%) of the title compound. 1H NMR (300 MHz, CDCl3): δ 8.8 (s, 1H), 7.2 (s, 1H), 7.1 (s, 1H), 3.82 (br. s, 2H).

후처리

  1. temperaturewas heated
  2. temperatureto reflux with vigorous stirring
  3. filtrationfiltered
  4. concentrationThe filtrate was concentrated
  5. additionaqueous sodium carbonate was added to the residue until it
  6. filtrationThis mixture was filtered through Celite
  7. washwashing with ethyl acetate
  8. customThe organic layer was separated
  9. washwashed with water
  10. dry with materialdried over anhydrous sodium sulfate
  11. concentrationconcentrated

출처 및 근거

ORD 기록
ord-6d655562fa0d41e1b89203cf9d38a70e
출처 데이터셋
uspto-grants-2013_02
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08378104B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트