Benzene → Picolinic acid

HRID 1218640Notes

Reaction equation

HRID 1218640 reaction equation
[C:1](=[O:2])([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[c:9]1[c:10]([C:15](=[O:16])[OH:17])[n:11][cH:12][cH:13][cH:14]1.[CH3:30][C:31]([O:32][C:33](=[O:34])[CH3:35])=[O:36].[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[NH2:18][c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1.[Na+:38].[OH-:37].[S:25](=[O:26])(=[O:27])([OH:28])[OH:29].[cH:46]1[cH:47][cH:48][cH:49][cH:50][cH:51]1>>[cH:9]1[c:10]([C:15](=[O:16])[OH:17])[n:11][cH:12][cH:13][cH:14]1

Participants

9

Reactant 8

HCID 241BenzeneHCID 923Sodium ionHCID 961HydroxideHCID 1118Sulfuric AcidHCID 1140TolueneHCID 6115AnilineHCID 7918Acetic AnhydrideHCID 7269413-Benzoylpicolinic acid

Product 1

HCID 1018Picolinic acid

Sources & evidence

ORD record
ord-7e1a12a7f6474ea0a50e057dab1f325d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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