Methanol → 4-[3-(1-Benzylimidazol-2-yl)prop-1-en-1-yl]-2-(4-fluorophenyl)benzoic acid

HRID 1141459Notes

Reaction equation

HRID 1141459 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH2:13][CH:14]=[CH:15][c:16]2[cH:17][c:18](-[c:26]3[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]3)[c:19]([C:20](=[O:21])[O:22][CH3:23])[cH:24][cH:25]2)[n:10][cH:11][cH:12]1.[CH3:36][OH:37].[Na+:34].[OH-:33].[OH2:35]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[n:8]1[c:9]([CH2:13][CH:14]=[CH:15][c:16]2[cH:17][c:18](-[c:26]3[cH:27][cH:28][c:29]([F:32])[cH:30][cH:31]3)[c:19]([C:20](=[O:21])[OH:22])[cH:24][cH:25]2)[n:10][cH:11][cH:12]1

Participants

6

Reactant 5

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 53719705Methyl 4-[3-(1-benzylimidazol-2-yl)prop-1-en-1-yl]-2-(4-fluorophenyl)benzoate

Product 1

HCID 544808904-[3-(1-Benzylimidazol-2-yl)prop-1-en-1-yl]-2-(4-fluorophenyl)benzoic acid

Sources & evidence

ORD record
ord-cc3035ec1eea4d67be37655a9da5a7ff
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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