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

Cysteamine Hydrochloride → 3-[(2-Aminoethyl)thiomethyl]isothiazole hydrochloride

HRID 26866
노트
인쇄 미리보기

반응식

HRID 26866 반응식
[ClH:1].[NH2:2][CH2:3][CH2:4][SH:5].[Na].Br[CH2:8][C:9]1[CH:13]=[CH:12][S:11][N:10]=1>C(O)C>[ClH:1].[NH2:2][CH2:3][CH2:4][S:5][CH2:8][C:9]1[CH:13]=[CH:12][S:11][N:10]=1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

5

반응물 3

HCID 9082Cysteamine HydrochlorideHCID 5360545SodiumHCID 130375983-(bromomethyl)Isothiazole

생성물 1

HCID 205502093-[(2-Aminoethyl)thiomethyl]isothiazole hydrochloride수율 92.9%

시약·촉매·용매 1

HCID 702Ethanol용매

실험 절차

A solution was prepared by the gradual addition of cysteamine hydrochloride (2.03 g.) to sodium (0.83 g.) dissolved in ethanol (50 ml.) with stirring at 0° under a nitrogen atmosphere. After stirring for 2 hours at 0°, 3-bromomethylisothiazole (3.2 g.) was added dropwise over 15 minutes at 0°, the reaction mixture subsequently being set aside overnight at room temperature. Following acidification to pH 3.5 with hydrochloric acid, concentration and re-evaporation with ethanol, the residue was dissolved in ethanol, filtered and concentrated to yield 3-[(2-aminoethyl)thiomethyl]isothiazole hydrochloride (3.5 g.). This was converted directly to the free base by treatment with aqueous potassium carbonate and extraction with ether. The extracts were dried over magnesium sulphate, filtered and concentrated to yield the amine base as an oil (1.56 g.). The amine was dissolved in ethanol (10 ml.), methyl isothiocyanate (0.66 g.) added, and the solution heated under reflux for 30 minutes. Concentration, followed by purification of the crude product by chromatography on a column of silica gel with ethyl acetate as eluant followed by chromatography on a column of alumina with benzene-ethyl acetate as eluant gave N-methyl-N'-[2-(3-isothiazolylmethylthio)ethyl]thiourea. (Found: C, 38.9; H, 5.4; N, 16.5; S, 38.3. C8H13N3S3 requires: C, 38.8; H, 5.3; N, 17.0; S, 38.9).

후처리

  1. stirringAfter stirring for 2 hours at 0°
  2. concentrationwith hydrochloric acid, concentration and re-evaporation with ethanol
  3. dissolutionthe residue was dissolved in ethanol
  4. filtrationfiltered
  5. concentrationconcentrated

출처 및 근거

ORD 기록
ord-b3ac9cbf2c934db49e55e03a9beece1d
출처 데이터셋
uspto-grants-1979_04
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US04151288

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트