Ethanol → p-Toluenesulfonic acid

HRID 1562626Notes

Reaction equation

HRID 1562626 reaction equation
[CH3:38][CH2:39][OH:40].[H:36][H:37].[c:12]1([CH:13]([CH3:14])[NH:20][CH:21]2[CH:22]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:23][C:24]3([O:25][CH2:26][CH2:27][O:28]3)[CH2:29][CH2:30]2)[cH:15][cH:16][cH:17][cH:18][cH:19]1.[c:1]1([CH3:11])[cH:2][cH:3][c:4]([S:7](=[O:8])(=[O:9])[OH:10])[cH:5][cH:6]1>>[NH2:20][CH:21]1[CH:22]([C:31](=[O:32])[O:33][CH2:34][CH3:35])[CH2:23][C:24]2([O:25][CH2:26][CH2:27][O:28]2)[CH2:29][CH2:30]1.[c:1]1([CH3:11])[cH:2][cH:3][c:4]([S:7](=[O:8])(=[O:9])[OH:10])[cH:5][cH:6]1

Participants

6

Reactant 4

HCID 702EthanolHCID 6101p-Toluenesulfonic acidHCID 69287240HCID 69287240, compoundHCID 178418361HCID 178418361, compound

Product 2

HCID 6101p-Toluenesulfonic acidHCID 14552384HCID 14552384, compound

Sources & evidence

ORD record
ord-698ed74cc62149659802e797c87d01e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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