4-tert-Butylphenol → Methyl alpha-(p-tert-butylphenoxy)-alpha-[p-(alpha,alpha,alpha-trifluoro-m-tolyloxy)phenyl]acetate

HRID 177700

반응식

HRID 177700 반응식
[Br:1][CH:2]([C:3](=[O:4])[O:5][CH3:6])[c:7]1[cH:8][cH:9][c:10]([O:13][c:14]2[cH:15][c:16]([C:20]([F:21])([F:22])[F:23])[cH:17][cH:18][cH:19]2)[cH:11][cH:12]1.[C:24]([CH3:25])([CH3:26])([CH3:27])[c:28]1[cH:29][cH:30][c:31]([OH:34])[cH:32][cH:33]1>>[CH:2]([C:3](=[O:4])[O:5][CH3:6])([c:7]1[cH:8][cH:9][c:10]([O:13][c:14]2[cH:15][c:16]([C:20]([F:21])([F:22])[F:23])[cH:17][cH:18][cH:19]2)[cH:11][cH:12]1)[O:34][c:31]1[cH:30][cH:29][c:28]([C:24]([CH3:25])([CH3:26])[CH3:27])[cH:33][cH:32]1

참가 물질

3

반응물 2

HCID 73934-tert-ButylphenolHCID 20392575Methyl alpha-bromo-alpha-[p-(alpha,alpha,alpha-trifluoro-m-tolyloxy)phenyl]acetate

생성물 1

HCID 12531890Methyl alpha-(p-tert-butylphenoxy)-alpha-[p-(alpha,alpha,alpha-trifluoro-m-tolyloxy)phenyl]acetate

출처 및 근거

ORD 기록
ord-c9eddb474e2a45e6998b90dd28276dc1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

연결된 노트

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