Acetic Acid → 2-(3,5-Dimethylphenyl)-1H-indol-5-amine

HRID 1226516Notes

Reaction equation

HRID 1226516 reaction equation
[CH3:1][c:2]1[cH:3][c:4](-[c:9]2[nH:10][c:11]3[cH:12][cH:13][c:14]([N+:18]([O-:19])=[O:20])[cH:15][c:16]3[cH:17]2)[cH:5][c:6]([CH3:8])[cH:7]1.[CH3:21][C:22](=[O:23])[OH:24].[CH3:32][OH:33].[H:25][H:26].[O:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1.[OH-:35].[OH-:37].[OH2:34].[Pd+2:36]>>[CH3:1][c:2]1[cH:3][c:4](-[c:9]2[nH:10][c:11]3[cH:12][cH:13][c:14]([NH2:18])[cH:15][c:16]3[cH:17]2)[cH:5][c:6]([CH3:8])[cH:7]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 887MethanolHCID 961Hydroxide2×HCID 962WaterHCID 8028TetrahydrofuranHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 21254069HCID 21254069, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 212541012-(3,5-Dimethylphenyl)-1H-indol-5-amine

Sources & evidence

ORD record
ord-18e21c4be1174fe290fc2d9eb49f7f67
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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