Ammonium → 2-Benzyl 1-t-butyl 5-bromo-1H-pyrrole-1,2-dicarboxylate

Reaction equation

[Br:1][c:2]1[n:3]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[c:4]([Br:7])[cH:5][cH:6]1.[CH2:15]([Li:16])[CH2:17][CH2:18][CH3:19].[CH3:33][CH2:34][O:35][CH2:36][CH3:37].[Cl-:31].[Cl:20][C:21](=[O:22])[O:23][CH2:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[NH4+:32]>>[c:2]1([C:21](=[O:22])[O:23][CH2:24][c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[n:3]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[c:4]([Br:7])[cH:5][cH:6]1

Participants

Reactant 6

HCID 223Ammonium

HCID 312Chloride

HCID 3283Diethyl Ether

HCID 10387Benzyl chloroformate

HCID 11099400tert-Butyl 2,5-dibromo-1H-pyrrole-1-carboxylate

HCID 178418339Butyllithium

Product 1

HCID 666830832-Benzyl 1-t-butyl 5-bromo-1H-pyrrole-1,2-dicarboxylate

Sources & evidence

ORD record: ord-372ed727712c4737a276d021af812dd1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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