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Dimethyl Sulfoxide → Propanoic acid, 2-((1-(3-(trifluoromethyl)phenyl)-1H-1,2,4-triazol-3-yl)oxy)-, ethyl ester

HRID 1126437
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HRID 1126437 반응식
[Br:22][CH:23]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[CH3:29].[CH3:2][S:3]([CH3:4])=[O:5].[CH3:30][OH:31].[Na:1].[OH:6][c:7]1[n:8][n:9](-[c:12]2[cH:13][c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][cH:16][cH:17]2)[cH:10][n:11]1>>[O:6]([c:7]1[n:8][n:9](-[c:12]2[cH:13][c:14]([C:18]([F:19])([F:20])[F:21])[cH:15][cH:16][cH:17]2)[cH:10][n:11]1)[CH:23]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[CH3:29]
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6

반응물 5

HCID 679Dimethyl SulfoxideHCID 887MethanolHCID 79040Ethyl 2-bromopropionateHCID 5360545SodiumHCID 178517993HCID 178517993, 화합물

생성물 1

HCID 184260Propanoic acid, 2-((1-(3-(trifluoromethyl)phenyl)-1H-1,2,4-triazol-3-yl)oxy)-, ethyl ester

출처 및 근거

ORD 기록
ord-6adb836c425a41e2b43ef230846a7e07
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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