tert-Butyl bromoacetate → Tert-butyl 2-(2-fluoro-4-(3-oxo-3-(5-(4-(trifluoromethyl)phenyl)thien-2-yl)propyl)phenoxy)acetate

반응식

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

참가 물질

반응물 2

HCID 79177tert-Butyl bromoacetate

HCID 591803393-(3-Fluoro-4-hydroxyphenyl)-1-(5-(4-(trifluoromethyl)phenyl)thien-2-yl)propan-1-one

생성물 1

HCID 59180362Tert-butyl 2-(2-fluoro-4-(3-oxo-3-(5-(4-(trifluoromethyl)phenyl)thien-2-yl)propyl)phenoxy)acetate

출처 및 근거

ORD 기록: ord-8c9fd997920c430989e2d6f6cd5c3287
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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