Ammonium → Oxalic Acid

HRID 93069Notes

Reaction equation

HRID 93069 reaction equation
[C:1]([C:2](=[O:3])[OH:4])(=[O:5])[OH:6].[NH4+:36].[OH-:37].[c:7]1([CH:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:30]2)[N:14]2[CH:15]([CH3:29])[CH:16]([O:18][c:19]3[cH:20][c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]3)[CH2:17]2)[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[C:1]([C:2](=[O:3])[OH:4])(=[O:5])[OH:6].[NH:14]1[CH:15]([CH3:29])[CH:16]([O:18][c:19]2[cH:20][c:21]([C:25]([F:26])([F:27])[F:28])[cH:22][cH:23][cH:24]2)[CH2:17]1

Participants

6

Reactant 4

HCID 223AmmoniumHCID 961HydroxideHCID 971Oxalic AcidHCID 198758131-Benzhydryl-2-methyl-3-[3-(trifluoromethyl)phenoxy]azetidine

Product 2

HCID 971Oxalic AcidHCID 197995782-Methyl-3-[3-(trifluoromethyl)phenoxy]azetidine

Sources & evidence

ORD record
ord-1fef0a8e7f9c4bba8e7f79694acf319a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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