Sodium ion → 2-Phenylpiperazine

HRID 689738Notes

Reaction equation

HRID 689738 reaction equation
[Al+3:15].[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[H-:14].[H-:17].[H-:18].[H-:19].[Li+:16].[Na+:35].[Na+:36].[O:1]=[C:2]1[NH:3][CH2:4][CH2:5][NH:6][CH:7]1[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[OH2:20].[OH2:21].[OH2:22].[OH2:23].[OH2:24].[OH2:25].[OH2:26].[OH2:27].[OH2:28].[OH2:29].[S:30]([O-:31])([O-:32])(=[O:33])=[O:34]>>[CH2:2]1[NH:3][CH2:4][CH2:5][NH:6][CH:7]1[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1

Participants

9

Reactant 8

HCID 923Sodium ion2×HCID 962Water10×HCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 2506813-Phenylpiperazin-2-one

Product 1

HCID 2506732-Phenylpiperazine

Sources & evidence

ORD record
ord-6fe89faf91ae4adf9c108a4fc5df1ead
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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