Water → Tert-butyl 4-(2-(4-amino-3-nitrophenoxy)ethyl)piperazine-1-carboxylate

Reaction equation

[Br:1][CH2:2][CH2:3][O:4][c:5]1[cH:6][c:7]([N+:12](=[O:13])[O-:14])[c:8]([NH2:9])[cH:10][cH:11]1.[C:15](=[O:16])([O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[N:22]1[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]1.[CH2:29]1[O:30][CH2:31][CH2:32][CH2:33]1.[OH2:28]>>[CH2:2]([CH2:3][O:4][c:5]1[cH:6][c:7]([N+:12](=[O:13])[O-:14])[c:8]([NH2:9])[cH:10][cH:11]1)[N:25]1[CH2:24][CH2:23][N:22]([C:15](=[O:16])[O:17][C:18]([CH3:19])([CH3:20])[CH3:21])[CH2:27][CH2:26]1

Participants

Reactant 4

HCID 962Water

HCID 8028Tetrahydrofuran

HCID 143452tert-Butyl piperazine-1-carboxylate

HCID 154854442-(4-Amino-3-nitrophenoxy)ethyl bromide

Product 1

HCID 66623212Tert-butyl 4-(2-(4-amino-3-nitrophenoxy)ethyl)piperazine-1-carboxylate

Sources & evidence

ORD record: ord-dc1c263a82a648c3a873575ad3de10a5
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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