1-Chloro-2,4-Dinitrobenzene → Methyl 3-(2,4-dinitroanilino)-3-phenylpropanoate

HRID 1134489Notes

Reaction equation

HRID 1134489 reaction equation
[CH3:27][CH2:28][N:29]([CH2:30][CH3:31])[CH2:32][CH3:33].[CH3:34][OH:35].[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([Cl:13])[cH:6][cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1.[NH2:14][CH:15]([CH2:16][C:17](=[O:18])[O:19][CH3:20])[c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[N+:1](=[O:2])([O-:3])[c:4]1[c:5]([NH:14][CH:15]([CH2:16][C:17](=[O:18])[O:19][CH3:20])[c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:6][cH:7][c:8]([N+:10](=[O:11])[O-:12])[cH:9]1

Participants

5

Reactant 4

HCID 61-Chloro-2,4-DinitrobenzeneHCID 887MethanolHCID 8471TriethylamineHCID 2755328Methyl 3-amino-3-phenylpropionate

Product 1

HCID 72383277Methyl 3-(2,4-dinitroanilino)-3-phenylpropanoate

Sources & evidence

ORD record
ord-c86aaa45ca9c4adfb47ca24b13ac3410
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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