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Sodium Ion → 3-(4-Ethoxyphenyl)-3-oxopropanenitrile

HRID 2320261
Notes
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Reaction equation

HRID 2320261 reaction equation
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([C:8]([O:10][CH2:9][CH3:11])=[O:12])[cH:13][cH:14]1.[CH3:16][CH2:17][O-:18].[CH3:19][C:20]#[N:21].[CH3:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[Na+:15].[OH2:29]>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([C:8](=[O:10])[CH2:19][C:20]#[N:21])[cH:13][cH:14]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 923Sodium IonHCID 962WaterHCID 1140TolueneHCID 6342AcetonitrileHCID 90232Ethyl 4-ethoxybenzoateHCID 1194401-Hydroxyethyl radical

Product 1

HCID 222416953-(4-Ethoxyphenyl)-3-oxopropanenitrile

Sources & evidence

ORD record
ord-3f0fa7bbbbb042dc8602aea46b154489
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes