Isopropanol → HCID 54418509, compound

HRID 699470Notes

Reaction equation

HRID 699470 reaction equation
[Al+3:22].[CH3:18][CH:19]([CH3:20])[O-:21].[CH3:23][CH:24]([CH3:25])[O-:26].[CH3:27][CH:28]([CH3:29])[O-:30].[CH:31]([OH:32])([CH3:33])[CH3:34].[c:1]1(-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][c:4]([CH:7]=[CH:8][C:9]([CH3:10])=[O:11])[cH:5][cH:6]1>>[c:1]1(-[c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[cH:2][cH:3][c:4]([CH:7]=[CH:8][CH:9]([CH3:10])[OH:11])[cH:5][cH:6]1

Participants

5

Reactant 4

HCID 3776IsopropanolHCID 104727Aluminum CationHCID 208771HCID 208771, compoundHCID 3260420Isopropanolate3×

Product 1

HCID 54418509HCID 54418509, compound

Sources & evidence

ORD record
ord-edcc82c236c74684841ae5f18d646b41
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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