Acetic Acid → tert-Butyl 4-(3-bromobenzylamino)piperidine-1-carboxylate

Reaction equation

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

Participants

Reactant 6

HCID 176Acetic Acid

HCID 260Hydrogen Bromide

HCID 887Methanol

HCID 962Water

HCID 457587Benzenemethanamine, 3-bromo-

HCID 735900tert-Butyl 4-oxopiperidine-1-carboxylate

Product 1

HCID 11617611tert-Butyl 4-(3-bromobenzylamino)piperidine-1-carboxylate

Sources & evidence

ORD record: ord-3a86ad9beeb14d43a4f9bc30a287b9ae
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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