Trifluoroacetic acid → 2-(5-Bromo-pyridin-3-yl)-3,3-dimethyl-1,2,3,4-tetrahydro-quinoline-6-carboxylic acid ethyl ester

반응식

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][n:18][cH:19][c:20]([Br:22])[cH:21]1)[C:10]([CH3:23])([CH3:24])[CH:9]2[OH:25].[CH2:33]([SiH:34]([CH2:35][CH3:36])[CH2:37][CH3:38])[CH3:39].[OH:26][C:27]([C:28]([F:29])([F:30])[F:31])=[O:32]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:13]([cH:14][cH:15]1)[NH:12][CH:11]([c:16]1[cH:17][n:18][cH:19][c:20]([Br:22])[cH:21]1)[C:10]([CH3:23])([CH3:24])[CH2:9]2

참가 물질

반응물 3

HCID 6422Trifluoroacetic acid

HCID 12052Triethylsilane

HCID 674425242-(5-Bromo-pyridin-3-yl)-4-hydroxy-3,3-dimethyl-1,2,3,4-tetrahydro-quinoline-6-carboxylic acid ethyl ester

생성물 1

HCID 674409002-(5-Bromo-pyridin-3-yl)-3,3-dimethyl-1,2,3,4-tetrahydro-quinoline-6-carboxylic acid ethyl ester

출처 및 근거

ORD 기록: ord-f12e3fd360f64ec8b782f48e105c8c19
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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