Methanol → 2-[2-(4-Fluoro-phenyl)-6-(4-trifluoromethyl-phenyl)-pyridin-4-yl]-4-methyl-pentanoic acid methyl ester

반응식

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

참가 물질

반응물 2

HCID 887Methanol

HCID 591617282-[2-(4-Fluoro-phenyl)-6-(4-trifluoromethyl-phenyl)-pyridin-4-yl]-4-methyl-pent-4-enoic acid methyl ester

생성물 1

HCID 591617082-[2-(4-Fluoro-phenyl)-6-(4-trifluoromethyl-phenyl)-pyridin-4-yl]-4-methyl-pentanoic acid methyl ester

출처 및 근거

ORD 기록: ord-2ad0e19afcdc4933b8f37c56f59e5521
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

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