Acetone → 2-Cyanomethoxy-5-(1,1-dimethylethyl)benzenamine

HRID 2135596Notes

Reaction equation

HRID 2135596 reaction equation
[C:13](=[O:14])([O-:15])[O-:16].[CH3:23][C:24](=[O:25])[CH3:26].[CH3:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[Cl:19][CH2:20][C:21]#[N:22].[K+:17].[K+:18].[NH2:1][c:2]1[c:3]([OH:12])[cH:4][cH:5][c:6]([C:8]([CH3:9])([CH3:10])[CH3:11])[cH:7]1>>[NH2:1][c:2]1[c:3]([O:12][CH2:20][C:21]#[N:22])[cH:4][cH:5][c:6]([C:8]([CH3:9])([CH3:10])[CH3:11])[cH:7]1

Participants

8

Sources & evidence

ORD record
ord-f13c765e042e4d4da87dafa37b44f536
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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