Sodium ion → 2-Acetyl-4-[4-(2-hydroxyethyl)piperazin-1-yl-methyl]phenol

HRID 121668Notes

Reaction equation

HRID 121668 reaction equation
[C:10]([CH3:11])(=[O:12])[c:13]1[c:14]([OH:21])[cH:15][cH:16][c:17]([CH2:19][Cl:20])[cH:18]1.[C:34]([O:35][CH2:36][CH3:37])(=[O:38])[CH3:39].[CH3:28][CH2:29][CH2:30][CH2:31][CH2:32][CH3:33].[CH:40]([Cl:41])([Cl:42])[Cl:43].[N:1]1([CH2:7][CH2:8][OH:9])[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1.[Na+:22].[Na+:23].[O-:24][C:25](=[O:26])[O-:27]>>[N:1]1([CH2:7][CH2:8][OH:9])[CH2:2][CH2:3][N:4]([CH2:19][c:17]2[cH:16][cH:15][c:14]([OH:21])[c:13]([C:10]([CH3:11])=[O:12])[cH:18]2)[CH2:5][CH2:6]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 6212ChloroformHCID 76771-(2-Hydroxyethyl)piperazineHCID 8058HexaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 22557013HCID 22557013, compound

Product 1

HCID 98604522-Acetyl-4-[4-(2-hydroxyethyl)piperazin-1-yl-methyl]phenol

Sources & evidence

ORD record
ord-f5b5932811954ac29a799c31ed56cc88
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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