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Ethanol → 4-(6-((3-(2,6-Dichlorophenyl)-5-isopropylisoxazol-4-yl)methoxy)pyridazin-3-yloxy)benzoic acid

HRID 168702
Notes
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Reaction equation

HRID 168702 reaction equation
[CH3:1][O:2][C:3]([c:4]1[cH:5][cH:6][c:7]([O:10][c:11]2[n:12][n:13][c:14]([O:17][CH2:18][c:19]3[c:20](-[c:27]4[c:28]([Cl:34])[cH:29][cH:30][cH:31][c:32]4[Cl:33])[n:21][o:22][c:23]3[CH:24]([CH3:25])[CH3:26])[cH:15][cH:16]2)[cH:8][cH:9]1)=[O:35].[CH3:39][CH2:40][OH:41].[Na+:37].[OH-:36].[OH2:38]>>[O:2]=[C:3]([c:4]1[cH:5][cH:6][c:7]([O:10][c:11]2[n:12][n:13][c:14]([O:17][CH2:18][c:19]3[c:20](-[c:27]4[c:28]([Cl:34])[cH:29][cH:30][cH:31][c:32]4[Cl:33])[n:21][o:22][c:23]3[CH:24]([CH3:25])[CH3:26])[cH:15][cH:16]2)[cH:8][cH:9]1)[OH:35]
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 672970344-{6-[3-(2,6-Dichloro-phenyl)-5-isopropyl-isoxazol-4-ylmethoxy]-pyridazin-3-yloxy}-benzoic acid methyl ester

Product 1

HCID 59448319
4-(6-((3-(2,6-Dichlorophenyl)-5-isopropylisoxazol-4-yl)methoxy)pyridazin-3-yloxy)benzoic acid

Sources & evidence

ORD record
ord-17cb8b42ae1c4e2d893d109aaedc193c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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