Indole → 1-(2-Aminophenyl)indole

HRID 1141565Notes

Reaction equation

[Br:10][c:11]1[c:12]([NH2:13])[cH:14][cH:15][cH:16][cH:17]1.[C:38]([O:39][CH2:40][CH3:41])(=[O:42])[CH3:43].[CH3:26][NH:27][CH:28]1[CH2:29][CH2:30][CH2:31][CH2:32][CH:33]1[NH:34][CH3:35].[CH3:44][CH2:45][CH2:46][CH2:47][CH2:48][CH3:49].[CH3:50][c:51]1[cH:52][cH:53][cH:54][cH:55][cH:56]1.[Cu:36][I:37].[K+:23].[K+:24].[K+:25].[P:18]([O-:19])([O-:20])([O-:21])=[O:22].[nH:1]1[cH:2][cH:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12>>[n:1]1(-[c:11]2[c:12]([NH2:13])[cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][c:4]2[cH:5][cH:6][cH:7][cH:8][c:9]12

Participants

Reactant 9

HCID 798Indole

HCID 813Potassium Cation3×

HCID 1061Phosphate

HCID 1140Toluene

HCID 8058Hexane

HCID 8857Ethyl Acetate

HCID 119922-Bromoaniline

HCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)

HCID 5510741-N,2-N-dimethylcyclohexane-1,2-diamine

Product 1

HCID 115139881-(2-Aminophenyl)indole

Sources & evidence

ORD record: ord-065e43f407cf4f5c8c1982dd82e5eb5c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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