Chloride → 2-(Bis(4-(dimethylamino)phenyl)methyl)-5-(dimethylamino)benzoic acid

HRID 701078Notes

Reaction equation

HRID 701078 reaction equation
[CH3:11][N:12]([c:13]1[cH:14][cH:15][c:16]([CH:19]2[O:20][C:21](=[O:22])[c:23]3[cH:24][c:25]([N:29]([CH3:30])[CH3:31])[cH:26][cH:27][c:28]32)[cH:17][cH:18]1)[CH3:32].[CH3:2][N:3]([CH3:4])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1.[Cl-:1].[Cl-:33].[Cl-:35].[Zn+2:34]>>[CH3:2][N:3]([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH:19]([c:16]2[cH:15][cH:14][c:13]([N:12]([CH3:11])[CH3:32])[cH:18][cH:17]2)[c:28]2[c:23]([C:21](=[O:20])[OH:22])[cH:24][c:25]([N:29]([CH3:30])[CH3:31])[cH:26][cH:27]2)[cH:9][cH:10]1

Participants

5

Reactant 4

HCID 312Chloride3×HCID 949N,N-DimethylanilineHCID 32051Zinc(2+)HCID 936931(3H)-Isobenzofuranone, 6-(dimethylamino)-3-[4-(dimethylamino)phenyl]-

Product 1

HCID 1020632-(Bis(4-(dimethylamino)phenyl)methyl)-5-(dimethylamino)benzoic acid

Sources & evidence

ORD record
ord-742fcaaab61e4590935d5fba015c5f58
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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