Potassium Cation → 2-Mercaptoethyl-5-nitrophenyl hydroxyethyl sulfone

Reaction equation

[C:17](=[O:18])([O-:19])[O-:20].[CH2:23]([CH3:24])[SH:25].[K+:21].[K+:22].[OH:1][CH2:2][CH2:3][S:4](=[O:5])(=[O:6])[c:7]1[c:8]([Cl:16])[cH:9][cH:10][c:11]([N+:13](=[O:14])[O-:15])[cH:12]1>>[OH:1][CH2:2][CH2:3][S:4](=[O:5])(=[O:6])[c:7]1[c:8]([CH2:24][CH2:23][SH:25])[cH:9][cH:10][c:11]([N+:13](=[O:14])[O-:15])[cH:12]1

Participants

Reactant 4

HCID 813Potassium Cation2×

HCID 6343Ethanethiol

HCID 19660Carbonate Ion

HCID 136286432-Chloro-5-nitrophenyl hydroxyethyl sulfone

Product 1

HCID 538699932-Mercaptoethyl-5-nitrophenyl hydroxyethyl sulfone

Sources & evidence

ORD record: ord-fa243ef8f6fb478baa8923facdaa8859
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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