Water → Benzoic acid, 2,6-dimethoxy-, methyl ester

HRID 191171

Reaction equation

HRID 191171 reaction equation
[CH3:12][O:13][c:14]1[c:15]([C:16](=[O:17])[OH:18])[c:19]([O:23][CH3:24])[cH:20][cH:21][cH:22]1.[CH3:25][O:26][C:27]([O:28][CH3:29])=[O:30].[CH3:31][CH2:32][O:33][C:34]([CH3:35])=[O:36].[N:1]12[CH2:2][CH2:11][CH2:10][CH2:9][CH2:8][C:7]1=[N:6][CH2:5][CH2:4][CH2:3]2.[OH2:37]>>[CH3:2][O:18][C:16]([c:15]1[c:14]([O:13][CH3:12])[cH:22][cH:21][cH:20][c:19]1[O:23][CH3:24])=[O:17]

Participants

6

Reactant 5

HCID 962WaterHCID 8857Ethyl AcetateHCID 12021Dimethyl CarbonateHCID 151092,6-Dimethoxybenzoic AcidHCID 811841,8-Diazabicyclo(5.4.0)undec-7-ene

Product 1

HCID 137419Benzoic acid, 2,6-dimethoxy-, methyl ester

Sources & evidence

ORD record
ord-08da53b1463c4014825ce97758153349
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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