Hydrochloric Acid → 4-Carboxymethyl-phenoxy-2-methyl-propionic acid tert-butyl ester

HRID 137721Notes

Reaction equation

HRID 137721 reaction equation
[Br:35][C:36]([CH3:37])([CH3:38])[C:39]([O:40][C:41]([CH3:42])([CH3:43])[CH3:44])=[O:45].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([C:7]([CH3:8])([CH3:9])[O:10][c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[O:20][CH3:21])[cH:15][cH:16]1)=[O:22].[ClH:48].[Li+:47].[O:50]1[CH2:51][CH2:52][O:53][CH2:54][CH2:55]1.[OH-:46].[OH2:49].[OH:23][c:24]1[cH:25][cH:26][c:27]([CH2:28][C:29]([O:30][CH3:31])=[O:32])[cH:33][cH:34]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([C:7]([CH3:8])([CH3:9])[O:10][c:11]1[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[OH:20])[cH:15][cH:16]1)=[O:22]

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 961HydroxideHCID 962WaterHCID 28486Lithium ionHCID 312751,4-DioxaneHCID 90290tert-Butyl 2-bromo-2-methylpropionateHCID 518900Benzeneacetic acid, 4-hydroxy-, methyl esterHCID 670720912-(4-Methoxycarbonylmethyl-phenoxy)-2-methyl-propionic acid tert-butyl ester

Product 1

HCID 670720574-Carboxymethyl-phenoxy-2-methyl-propionic acid tert-butyl ester

Sources & evidence

ORD record
ord-066158634fee4a4ca0a3b5b2184788c8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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