Toluene → N-(2,2-Diethoxyethyl)-N-ethyl-4-methyl-2,6-dinitroaniline

HRID 187127

Reaction equation

HRID 187127 reaction equation
[CH2:15]([CH3:16])[NH:17][CH2:18][CH:19]([O:20][CH2:21][CH3:22])[O:23][CH2:24][CH3:25].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[CH3:33][c:34]1[cH:35][cH:36][cH:37][cH:38][cH:39]1.[Cl:1][c:2]1[c:3]([N+:12](=[O:13])[O-:14])[cH:4][c:5]([CH3:11])[cH:6][c:7]1[N+:8](=[O:9])[O-:10]>>[c:2]1([N:17]([CH2:15][CH3:16])[CH2:18][CH:19]([O:20][CH2:21][CH3:22])[O:23][CH2:24][CH3:25])[c:3]([N+:12](=[O:13])[O-:14])[cH:4][c:5]([CH3:11])[cH:6][c:7]1[N+:8](=[O:9])[O-:10]

Participants

5

Reactant 4

HCID 1140TolueneHCID 8471TriethylamineHCID 789184-Chloro-3,5-dinitrotolueneHCID 125032612,2-Diethoxy-N-ethylethan-1-amine

Product 1

HCID 20492554N-(2,2-Diethoxyethyl)-N-ethyl-4-methyl-2,6-dinitroaniline

Sources & evidence

ORD record
ord-da493a8a855743cb9bf495481290dd9c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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