Sodium ion → 5-Amino-3-benzylamino-4-phenylbenzoic acid

HRID 1201577Notes

Reaction equation

HRID 1201577 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][c:9]1[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][c:16]([N+:24]([O-:25])=[O:26])[c:17]1-[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1.[Na+:33].[Na+:34].[OH2:41].[S:27]([S:28]([O-:29])=[O:30])([O-:31])=[O:32].[cH:35]1[cH:36][cH:37][n:38][cH:39][cH:40]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[NH:8][c:9]1[cH:10][c:11]([C:12](=[O:13])[OH:14])[cH:15][c:16]([NH2:24])[c:17]1-[c:18]1[cH:19][cH:20][cH:21][cH:22][cH:23]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 962WaterHCID 1049PyridineHCID 1086DithioniteHCID 124087723-Benzylamino-5-nitro-4-phenylbenzoic acid

Product 1

HCID 124087755-Amino-3-benzylamino-4-phenylbenzoic acid

Sources & evidence

ORD record
ord-eeb3942004324cbaaa428cc3748a3ab5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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