beta-Phenylisovaleric acid → HCID 18701946, compound

HRID 1554575Notes

Reaction equation

HRID 1554575 reaction equation
[CH2:14]([CH2:15][CH3:16])[c:17]1[c:18]([OH:19])[cH:20][cH:21][cH:22][c:23]1[OH:24].[CH3:1][C:2]([CH2:3][C:4](=[O:5])[OH:6])([CH3:7])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[OH:25][S:26]([C:27]([F:28])([F:29])[F:30])(=[O:31])=[O:32]>>[CH3:1][C:2]([CH2:3][C:4](=[O:6])[c:22]1[cH:21][cH:20][c:18]([OH:19])[c:17]([CH2:14][CH2:15][CH3:16])[c:23]1[OH:24])([CH3:7])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1

Participants

4

Reactant 3

HCID 13890beta-Phenylisovaleric acidHCID 62406Trifluoromethanesulfonic acidHCID 2620601,3-Benzenediol, propyl-

Product 1

HCID 18701946HCID 18701946, compound

Sources & evidence

ORD record
ord-a6806c70e7ed4570a8ad2ca51206f84c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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