Ethanol → 4-(2-(4-Isopropylbenzamido)ethoxy)benzoic acid

HRID 283439

Reaction equation

HRID 283439 reaction equation
[CH3:28][CH2:29][OH:30].[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[NH:10][CH2:11][CH2:12][O:13][c:14]2[cH:15][cH:16][c:17]([C:18](=[O:19])[O:20][CH3:21])[cH:22][cH:23]2)[cH:24][cH:25]1.[Na+:27].[OH-:26].[OH2:31]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[cH:5][cH:6][c:7]([C:8](=[O:9])[NH:10][CH2:11][CH2:12][O:13][c:14]2[cH:15][cH:16][c:17]([C:18](=[O:19])[OH:20])[cH:22][cH:23]2)[cH:24][cH:25]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 14426623Methyl 4-[2-(4-isopropylbenzamido)ethoxy]benzoate

Product 1

HCID 30810274-(2-(4-Isopropylbenzamido)ethoxy)benzoic acid

Sources & evidence

ORD record
ord-6443ebde34274230822002efe687eaba
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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