Water → Acrylic Acid

HRID 2331542Notes

Reaction equation

HRID 2331542 reaction equation
[CH2:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][OH:13])[OH:14].[CH3:1][O:2][CH3:3].[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH3:4][O:5][CH3:6].[OH2:38].[OH:15][C:16](=[O:17])[CH:18]=[CH2:19].[c:20]1([CH3:21])[cH:22][cH:23][c:24]([S:25]([OH:26])(=[O:27])=[O:28])[cH:29][cH:30]1>>[CH2:7]([CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][OH:13])[OH:14].[CH3:1][O:2][CH3:3].[O:15]=[C:16]([OH:17])[CH:18]=[CH2:19]

Participants

9

Reactant 6

HCID 962WaterHCID 1140TolueneHCID 6101p-Toluenesulfonic acidHCID 6581Acrylic AcidHCID 8254Dimethyl Ether2×HCID 123741,6-Hexanediol

Product 3

HCID 6581Acrylic AcidHCID 8254Dimethyl EtherHCID 123741,6-Hexanediol

Sources & evidence

ORD record
ord-662987fd44924ac9a2abcf7ffed3214c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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