Methanol → 1-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone

HRID 303038

Reaction equation

HRID 303038 reaction equation
[CH3:23][OH:24].[CH3:25][c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]=[CH:9][C:10]([C:11]([CH3:12])([CH3:13])[CH3:14])=[O:15])[cH:6][cH:7]1.[OH:16][CH2:17][CH2:18][S:19][CH2:20][CH2:21][OH:22]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH2:8][CH2:9][C:10]([C:11]([CH3:12])([CH3:13])[CH3:14])=[O:15])[cH:6][cH:7]1

Participants

5

Reactant 4

HCID 887MethanolHCID 1140TolueneHCID 5447ThiodiglycolHCID 3060495-(4-Chlorophenyl)-2,2-dimethylpent-4-en-3-one

Product 1

HCID 946171-(4-Chlorophenyl)-4,4-dimethyl-3-pentanone

Sources & evidence

ORD record
ord-032e7df4027d43d095e449f26d9e5b47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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