Isopropanol → Acrylate

HRID 670553Notes

Reaction equation

HRID 670553 reaction equation
[Al+3:13].[CH2:14]([O:15][CH2:16][CH2:17][O:18][CH2:19][CH2:20][OH:21])[CH2:22][CH2:23][CH3:24].[CH3:25][O:26][c:27]1[cH:28][cH:29][c:30]([OH:31])[cH:32][cH:33]1.[CH:1]([CH3:2])([CH3:3])[O-:4].[CH:39]([OH:40])([CH3:41])[CH3:42].[CH:5]([CH3:6])([CH3:7])[O-:8].[CH:9]([O-:10])([CH3:11])[CH3:12].[OH:34][C:35](=[O:36])[CH:37]=[CH2:38]>>[Al+3:13].[CH:1]([CH3:2])([CH3:3])[O-:4].[CH:5]([CH3:6])([CH3:7])[O-:8].[O:34]=[C:35]([O-:36])[CH:37]=[CH2:38]

Participants

9

Reactant 6

HCID 3776IsopropanolHCID 6581Acrylic AcidHCID 8177Diethylene Glycol Monobutyl EtherHCID 90154-MethoxyphenolHCID 104727Aluminum CationHCID 3260420Isopropanolate3×

Product 3

HCID 25188AcrylateHCID 104727Aluminum CationHCID 3260420Isopropanolate2×

Sources & evidence

ORD record
ord-c2fa0567662b423fbc49646974703376
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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