Trifluoroacetic acid → 3-(6-(5-benzylbenzofuran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)propanoic acid

반응식

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]2[c:12]([cH:13][c:14](-[c:16]3[cH:17][c:18]4[c:23]([cH:24][cH:25]3)[CH2:22][N:21]([CH2:26][CH2:27][C:28](=[O:29])[O:30][C:31]([CH3:32])([CH3:33])[CH3:34])[CH2:20][CH2:19]4)[o:15]2)[cH:35]1.[F:36][C:37]([F:38])([F:39])[C:40]([OH:41])=[O:42]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]2[c:12]([cH:13][c:14](-[c:16]3[cH:17][c:18]4[c:23]([cH:24][cH:25]3)[CH2:22][N:21]([CH2:26][CH2:27][C:28](=[O:29])[OH:30])[CH2:20][CH2:19]4)[o:15]2)[cH:35]1

참가 물질

반응물 2

HCID 6422Trifluoroacetic acid

HCID 59595905Tert-butyl 3-(6-(5-benzylbenzofuran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)propanoate

생성물 1

HCID 167373213-(6-(5-benzylbenzofuran-2-yl)-3,4-dihydroisoquinolin-2(1H)-yl)propanoic acid

출처 및 근거

ORD 기록: ord-ba39b75352aa431e90118bea155438d9
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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