Bicarbonate Ion → Benzonitrile, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-

HRID 211790

Reaction equation

HRID 211790 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([CH:8]=[N:9][OH:10])[cH:11][c:12]([C:15]([CH3:16])([CH3:17])[CH3:18])[c:13]1[OH:14].[CH3:24][C:25]([O:26][C:27](=[O:28])[CH3:29])=[O:30].[CH3:31][CH2:32][O:33][CH2:34][CH3:35].[Na+:19].[OH:20][C:21](=[O:22])[O-:23]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([C:8]#[N:9])[cH:11][c:12]([C:15]([CH3:16])([CH3:17])[CH3:18])[c:13]1[OH:14]

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 3283Diethyl EtherHCID 7918Acetic AnhydrideHCID 3285904-Hydroxy-3,5-bis(t-butyl)benzaldoxime

Product 1

HCID 137274Benzonitrile, 3,5-bis(1,1-dimethylethyl)-4-hydroxy-

Sources & evidence

ORD record
ord-261867774de748bfb1179d7c13d2f4ce
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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