Water → 2,4,6-Trimethylbenzene-1-sulfonate

HRID 2153504Notes

Reaction equation

HRID 2153504 reaction equation
[Cl:24][CH2:25][Cl:26].[OH2:15].[c:1]1([CH3:14])[c:2]([S:9](=[O:10])(=[O:11])[O:12][NH2:13])[c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1.[n:16]1[cH:17][c:18]([CH2:22][OH:23])[cH:19][cH:20][cH:21]1>>[NH2:13][n+:16]1[cH:17][c:18]([CH2:22][OH:23])[cH:19][cH:20][cH:21]1.[c:1]1([CH3:14])[c:2]([S:9](=[O:10])(=[O:11])[O-:12])[c:3]([CH3:8])[cH:4][c:5]([CH3:7])[cH:6]1

Participants

6

Reactant 4

HCID 962WaterHCID 6344DichloromethaneHCID 75103-PyridinemethanolHCID 11830845O-(2,4,6-Trimethylbenzenesulfonyl)hydroxylamine

Product 2

HCID 38762462,4,6-Trimethylbenzene-1-sulfonateHCID 13419139(1-Aminopyridin-1-ium-3-yl)methanol

Sources & evidence

ORD record
ord-fdf05eff4ed54780865c073a88084cf5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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