Bromide ion → 2-(4-Ethylphenylmethyl)malononitrile

HRID 313682Notes

Reaction equation

HRID 313682 reaction equation
[Br-:23].[C:16](=[O:17])([O-:18])[O-:19].[CH2:1]([CH3:2])[c:3]1[cH:4][cH:5][c:6]([CH2:7][Br:8])[cH:9][cH:10]1.[CH2:24]([N+:25]([CH2:26][CH2:27][CH2:28][CH3:29])([CH2:30][CH2:31][CH2:32][CH3:33])[CH2:34][CH2:35][CH2:36][CH3:37])[CH2:38][CH2:39][CH3:40].[CH3:41][c:42]1[cH:43][cH:44][cH:45][cH:46][cH:47]1.[K+:20].[K+:21].[N:11]#[C:12][CH2:13][C:14]#[N:15].[OH2:22]>>[CH2:1]([CH3:2])[c:3]1[cH:4][cH:5][c:6]([CH2:7][CH:13]([C:12]#[N:11])[C:14]#[N:15])[cH:9][cH:10]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 813Potassium Cation2×HCID 962WaterHCID 1140TolueneHCID 8010MalononitrileHCID 16028TetrabutylammoniumHCID 19660Carbonate IonHCID 122315601-(Bromomethyl)-4-ethylbenzene

Product 1

HCID 821115992-(4-Ethylphenylmethyl)malononitrile

Sources & evidence

ORD record
ord-e645692fd36f4069a6494f66c5421599
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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