Bromide ion → HCID 178436018, compound

HRID 146244Notes

Reaction equation

HRID 146244 reaction equation
[Br-:27].[Br:18][CH2:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26].[CH3:28][CH2:29][CH2:30][CH2:31][N+:32]([CH2:33][CH2:34][CH2:35][CH3:36])([CH2:37][CH2:38][CH2:39][CH3:40])[CH2:41][CH2:42][CH2:43][CH3:44].[CH3:3][CH:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[N:11]1[CH2:12][CH:13]([CH2:16][OH:17])[CH2:14][CH2:15]1.[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Na+:2].[OH-:1].[OH2:45]>>[CH3:3][CH:4]([c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[N:11]1[CH2:12][CH:13]([CH2:16][O:17][CH2:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[CH2:14][CH2:15]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 1140TolueneHCID 16028TetrabutylammoniumHCID 79177tert-Butyl bromoacetateHCID 13772857HCID 13772857, compound

Product 1

HCID 178436018HCID 178436018, compound

Sources & evidence

ORD record
ord-bc3b0934da004adaa888f7da7741d16c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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