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Hydrochloric Acid → 4-Nitro-3-phenethylaminobenzonitrile

HRID 298252
Notes
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Reaction equation

HRID 298252 reaction equation
[CH2:15]([CH2:16][c:17]1[cH:18][cH:19][cH:20][cH:21][cH:22]1)[NH2:23].[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9][c:10]1[N+:11](=[O:12])[O-:13].[CH3:27][S:28]([CH3:29])=[O:30].[ClH:14].[ClH:26].[Na+:25].[OH-:24]>>[c:3]1([NH:23][CH2:15][CH2:16][c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:4][c:5]([C:6]#[N:7])[cH:8][cH:9][c:10]1[N+:11](=[O:12])[O-:13]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 313Hydrochloric Acid2×HCID 679Dimethyl SulfoxideHCID 923Sodium IonHCID 961HydroxideHCID 1001PhenethylamineHCID 108992273-Methoxy-4-nitrobenzonitrile

Product 1

HCID 221254994-Nitro-3-phenethylaminobenzonitrile

Sources & evidence

ORD record
ord-4fe1917582a8451ca9c0884f9e2b5be8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes