Acetic Acid → 2-Hydroxy-5-((3,5-bis(methoxycarbonyl)phenyl)azo)benzeneacetic acid

HRID 1123902Notes

Reaction equation

HRID 1123902 reaction equation
[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:12](=[O:13])[O:14][CH3:15])[cH:8][c:9]([NH2:11])[cH:10]1.[CH3:36][C:37](=[O:38])[OH:39].[ClH:32].[N:16]([O-:17])=[O:18].[Na+:19].[Na+:35].[OH-:31].[OH-:34].[OH2:33].[OH:20][c:21]1[c:22]([CH2:27][C:28](=[O:29])[OH:30])[cH:23][cH:24][cH:25][cH:26]1>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]([C:12](=[O:13])[O:14][CH3:15])[cH:8][c:9]([N:11]=[N:16][c:24]2[cH:23][c:22]([CH2:27][C:28](=[O:29])[OH:30])[c:21]([OH:20])[cH:26][cH:25]2)[cH:10]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 946NitriteHCID 961Hydroxide2×HCID 962WaterHCID 11970(2-Hydroxyphenyl)acetic acidHCID 66831Dimethyl 5-aminoisophthalate

Product 1

HCID 1273242-Hydroxy-5-((3,5-bis(methoxycarbonyl)phenyl)azo)benzeneacetic acid

Sources & evidence

ORD record
ord-3a5b966b1db4431db06596d9fba75c28
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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