Chloride → 2-(5-Bromo-3,3-dimethylpentyl)-5-chloro-3-phenylisoindole-1-carboxylic acid ethyl ester

HRID 1125010Notes

Reaction equation

HRID 1125010 reaction equation
[Br:24][CH2:25][CH2:26][C:27]([CH2:28][CH2:29][Br:30])([CH3:31])[CH3:32].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[nH:7][c:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:9]2[cH:10][c:11]([Cl:15])[cH:12][cH:13][c:14]12.[CH3:35][N:36]([CH3:37])[CH:38]=[O:39].[Cl-:34].[H-:22].[Na+:23].[Na+:33]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7]([CH2:29][CH2:28][C:27]([CH2:26][CH2:25][Br:24])([CH3:31])[CH3:32])[c:8](-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[c:9]2[cH:10][c:11]([Cl:15])[cH:12][cH:13][c:14]12

Participants

7

Reactant 6

HCID 312ChlorideHCID 923Sodium ion2×HCID 6228DimethylformamideHCID 166653HydrideHCID 128427101,5-Dibromo-3,3-dimethylpentaneHCID 54174784Ethyl 5-chloro-3-phenyl-2H-isoindole-1-carboxylate

Product 1

HCID 542622872-(5-Bromo-3,3-dimethylpentyl)-5-chloro-3-phenylisoindole-1-carboxylic acid ethyl ester

Sources & evidence

ORD record
ord-8434d2447d474d379f456cb2e7aca0fc
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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