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

Sodium Hydroxide → 3,4-dihydro-2H-1,4-benzothiazine-6-carbaldehyde

HRID 1518012
노트
인쇄 미리보기

반응식

HRID 1518012 반응식
[S:1]1[C:6]2[CH:7]=[CH:8][C:9]([CH2:11][OH:12])=[CH:10][C:5]=2[NH:4][CH2:3][CH2:2]1.COC(C1C=CC2SCC(=O)NC=2C=1)=O.[H-].[H-].[H-].[H-].[Li+].[Al+3].[OH-].[Na+]>CCOCC.O>[S:1]1[C:6]2[CH:7]=[CH:8][C:9]([CH:11]=[O:12])=[CH:10][C:5]=2[NH:4][CH2:3][CH2:2]1
참가 물질실험 절차후처리출처 및 근거반응 노트

참가 물질

7

반응물 4

HCID 14798Sodium HydroxideHCID 699501Methyl 3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-carboxylateHCID 21226445Aluminium lithium hydrideHCID 595606163,4-dihydro-2H-1,4-benzothiazin-6-ylmethanol

생성물 1

HCID 218736933,4-dihydro-2H-1,4-benzothiazine-6-carbaldehyde수율 58%

시약·촉매·용매 2

HCID 962
Water
용매
2회
HCID 3283Diethyl Ether용매

실험 절차

(3,4-Dihydro-2H-benzo[1,4]thiazin-6-yl)-methanol. To a solution of 3-oxo-3,4-dihydro-2H-benzo[1,4]thiazine-6-carboxylic acid methyl ester (750 mg, 3.4 mmol) in Et2O (32 mL) was added LiAlH4 (240 mg, 6.3 mmol) and the resulting suspension was stirred at RT for 24 h. The reaction mixture was cooled to 0° C. and treated with H2O (0.5 mL), 15% aq. NaOH (0.5 mL), and H2O (1.5 mL). The resulting suspension was filtered. The filtrate was concentrated to provide 340 mg (58%) of the title compound as an amber oil. MS (ESI): exact mass calculated for C9H11NOS, 181.06; m/z found, 182.1 [M+H]+. 1H NMR (500 MHz, CDCl3): 6.96 (d, J=7.9, 1H), 6.60 (dd, J=7.9, 1.6, 1H), 6.49 (d, J=7.9, 1H), 4.52 (s, 2H), 3.65-3.62 (m, 2H), 3.06-3.04 (m, 2H).

후처리

  1. temperatureThe reaction mixture was cooled to 0° C.
  2. filtrationThe resulting suspension was filtered
  3. concentrationThe filtrate was concentrated

출처 및 근거

ORD 기록
ord-ed3c92a5e5a04618bff7088454adf633
출처 데이터셋
uspto-grants-2012_07
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US08232391B2

반응 노트

불러오는 중…

이 페이지에서참가 물질실험 절차후처리출처 및 근거반응 노트