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Methanol → 2-(6-Chloro-5-(2,2,2-trifluoroethoxy)-4'-(trifluoromethyl)biphenyl-3-yl)-4-methylpentanoic acid

HRID 197277
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반응식

HRID 197277 반응식
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:36][OH:37].[Cl:1][c:2]1[c:3]([O:28][CH2:29][C:30]([F:31])([F:32])[F:33])[cH:4][c:5]([CH:18]([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:24][CH:25]([CH3:26])[CH3:27])[cH:6][c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]1.[Li+:35].[OH-:34].[OH2:43]>>[Cl:1][c:2]1[c:3]([O:28][CH2:29][C:30]([F:31])([F:32])[F:33])[cH:4][c:5]([CH:18]([C:19](=[O:20])[OH:21])[CH2:24][CH:25]([CH3:26])[CH3:27])[cH:6][c:7]1-[c:8]1[cH:9][cH:10][c:11]([C:14]([F:15])([F:16])[F:17])[cH:12][cH:13]1
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반응물 6

HCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 57995615Ethyl 2-(6-chloro-5-(2,2,2-trifluoroethoxy)-4'-(trifluoromethyl)biphenyl-3-yl)-4-methylpentanoate

생성물 1

HCID 44133048
2-(6-Chloro-5-(2,2,2-trifluoroethoxy)-4'-(trifluoromethyl)biphenyl-3-yl)-4-methylpentanoic acid

출처 및 근거

ORD 기록
ord-18bc877add2a41fb9f0b8c94efad0136
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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