Dimethyl Sulfoxide → tert-Butyl 4-(2-methyl-4-nitrophenyl)piperazine-1-carboxylate

HRID 2153106Notes

Reaction equation

HRID 2153106 reaction equation
[CH3:34][S:35]([CH3:36])=[O:37].[CH:25]([N:26]([CH2:27][CH3:28])[CH:29]([CH3:30])[CH3:31])([CH3:32])[CH3:33].[F:14][c:15]1[c:16]([CH3:24])[cH:17][c:18]([N+:21](=[O:22])[O-:23])[cH:19][cH:20]1.[N:1]1([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1>>[N:1]1([C:7](=[O:8])[O:9][C:10]([CH3:11])([CH3:12])[CH3:13])[CH2:2][CH2:3][N:4]([c:15]2[c:16]([CH3:24])[cH:17][c:18]([N+:21](=[O:22])[O-:23])[cH:19][cH:20]2)[CH2:5][CH2:6]1

Participants

5

Reactant 4

HCID 679Dimethyl SulfoxideHCID 68001Benzene, 1-fluoro-2-methyl-4-nitro-HCID 81531DiisopropylethylamineHCID 143452tert-Butyl piperazine-1-carboxylate

Product 1

HCID 22336105tert-Butyl 4-(2-methyl-4-nitrophenyl)piperazine-1-carboxylate

Sources & evidence

ORD record
ord-4eb06a91128343edbb6b3d7522107d24
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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