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Sodium Ion → Ethyl [5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]acetate

HRID 1572787
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HRID 1572787 반응식
[C:48](=[O:49])([O-:50])[O-:51].[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([O:20][CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[cH:9][c:10]([O:12][S:13]([C:14]([F:15])([F:16])[F:17])(=[O:18])=[O:19])[cH:11]1)=[O:28].[CH3:42][O:43][CH2:44][CH2:45][O:46][CH3:47].[CH3:54][CH2:55][O:56][C:57]([CH3:58])=[O:59].[F:29][C:30]([c:31]1[cH:32][cH:33][c:34]([B:37]([OH:38])[OH:39])[cH:35][cH:36]1)([F:40])[F:41].[Na+:52].[Na+:53]>>[CH2:1]([CH3:2])[O:3][C:4]([CH2:5][c:6]1[cH:7][c:8]([O:20][CH2:21][c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[cH:9][c:10](-[c:34]2[cH:33][cH:32][c:31]([C:30]([F:29])([F:40])[F:41])[cH:36][cH:35]2)[cH:11]1)=[O:28]
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반응물 6

HCID 923Sodium Ion2회HCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 27343894-(Trifluoromethyl)phenylboronic acidHCID 57755048(3-Benzyloxy-5-trifluoromethanesulfonyloxy-phenyl)-acetic acid ethyl ester

생성물 1

HCID 24771790
Ethyl [5-benzyloxy-4'-(trifluoromethyl)biphenyl-3-yl]acetate

출처 및 근거

ORD 기록
ord-5a1ec5bd76614d2b81c21c57dc8b080c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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