Isopropanol → 3-(3-Isopropylphenyl)butanol

HRID 1127117Notes

Reaction equation

HRID 1127117 reaction equation
[Al+3:5].[CH3:10][CH:11]([CH3:12])[O-:13].[CH3:1][CH:2]([CH3:3])[O-:4].[CH3:6][CH:7]([CH3:8])[O-:9].[CH:14]([CH3:15])([CH3:16])[c:17]1[cH:18][c:19]([CH:23]([CH2:24][CH:25]=[O:26])[CH3:27])[cH:20][cH:21][cH:22]1.[CH:28]([OH:29])([CH3:30])[CH3:31]>>[CH:14]([CH3:15])([CH3:16])[c:17]1[cH:18][c:19]([CH:23]([CH2:24][CH2:25][OH:26])[CH3:27])[cH:20][cH:21][cH:22]1

Participants

5

Reactant 4

HCID 3776IsopropanolHCID 86209FlorhydralHCID 104727Aluminum CationHCID 3260420Isopropanolate3×

Product 1

HCID 220355223-(3-Isopropylphenyl)butanol

Sources & evidence

ORD record
ord-ff540add7237405597e3fe2feaa487e3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…