Ammonium → 1-(5-Nitro-indol-1-yl)-2-phenyl-ethanone

HRID 155396Notes

Reaction equation

HRID 155396 reaction equation
[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Cl-:15].[Cl-:26].[H-:13].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[cH:7][cH:8][nH:9][c:10]2[cH:11][cH:12]1.[NH4+:27].[Na+:14].[O:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1.[c:16]1([CH2:22][C:23](=[O:24])[OH:25])[cH:17][cH:18][cH:19][cH:20][cH:21]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]2[cH:7][cH:8][n:9]([C:23]([CH2:22][c:16]3[cH:17][cH:18][cH:19][cH:20][cH:21]3)=[O:24])[c:10]2[cH:11][cH:12]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312Chloride2×HCID 923Sodium ionHCID 999Phenylacetic AcidHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 225235-NitroindoleHCID 166653Hydride

Product 1

HCID 593348921-(5-Nitro-indol-1-yl)-2-phenyl-ethanone

Sources & evidence

ORD record
ord-12460d9322cb4f22be4620db682cc43b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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