Acetonitrile → tert-Butyl 4-((4-nitrobenzo[d]oxazol-2-yl)methyl)piperazine-1-carboxylate

HRID 2129127Notes

Reaction equation

HRID 2129127 reaction equation
[C:24](=[O:25])([O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[N:31]1[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]1.[CH3:37][C:38]#[N:39].[CH3:40][CH2:41][O:42][C:43]([CH3:44])=[O:45].[CH:15]([N:16]([CH2:17][CH3:18])[CH:19]([CH3:20])[CH3:21])([CH3:22])[CH3:23].[Cl:1][CH2:2][c:3]1[o:4][c:5]2[c:6]([n:7]1)[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]2>>[CH2:2]([c:3]1[o:4][c:5]2[c:6]([n:7]1)[c:8]([N+:12](=[O:13])[O-:14])[cH:9][cH:10][cH:11]2)[N:34]1[CH2:33][CH2:32][N:31]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:36][CH2:35]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 81531DiisopropylethylamineHCID 143452tert-Butyl piperazine-1-carboxylateHCID 99907762-(Chloromethyl)-4-nitro-1,3-benzoxazole

Product 1

HCID 59302730tert-Butyl 4-((4-nitrobenzo[d]oxazol-2-yl)methyl)piperazine-1-carboxylate

Sources & evidence

ORD record
ord-fac6ff55af6b45b687ae7d12e7e0ed9b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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