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Bromide ion → 4-[(3-Fluorophenyl)methyl]-5-(4-methylsulfonylphenyl)-2-(2,2,2-trifluoroethyl)pyridazin-3-one

HRID 1130572
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HRID 1130572 반응식
[Br-:24].[CH2:34]1[O:35][CH2:36][CH2:37][CH2:38]1.[CH2:39]([Cl:40])[Cl:41].[F:1][C:2]([CH2:3][n:4]1[n:5][cH:6][c:7](-[c:12]2[cH:13][cH:14][c:15]([S:18](=[O:19])(=[O:20])[CH3:21])[cH:16][cH:17]2)[c:8]([Cl:11])[c:9]1=[O:10])([F:22])[F:23].[F:25][c:26]1[cH:27][c:28]([CH2:29][Mg+:30])[cH:31][cH:32][cH:33]1>>[F:1][C:2]([CH2:3][n:4]1[n:5][cH:6][c:7](-[c:12]2[cH:13][cH:14][c:15]([S:18](=[O:19])(=[O:20])[CH3:21])[cH:16][cH:17]2)[c:8]([CH2:29][c:28]2[cH:27][c:26]([F:25])[cH:33][cH:32][cH:31]2)[c:9]1=[O:10])([F:22])[F:23]
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참가 물질

6

반응물 5

HCID 259Bromide ionHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 219343142-(2,2,2-trifluoroethyl)-4-chloro-5-[4-(methylsulfonyl)phenyl]-3(2H)-pyridazinoneHCID 178505695HCID 178505695, 화합물

생성물 1

HCID 219340624-[(3-Fluorophenyl)methyl]-5-(4-methylsulfonylphenyl)-2-(2,2,2-trifluoroethyl)pyridazin-3-one
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출처 및 근거

ORD 기록
ord-7f8a8f96d5c341088a3ae98baf1a1df3
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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