2-Bromo-1-(4-hydroxyphenyl)ethanone → Bromide ion

HRID 191333Notes

Reaction equation

HRID 191333 reaction equation
[Br:1][CH2:2][C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([OH:11])[cH:9][cH:10]1.[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[c:12]1([CH:18]([C:19](=[O:20])[O:21][CH:22]2[CH2:23][N:24]3[CH2:25][CH2:26][CH:27]2[CH2:28][CH2:29]3)[NH:30][c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[cH:13][cH:14][cH:15][cH:16][cH:17]1>>[Br-:1].[CH2:2]([C:3](=[O:4])[c:5]1[cH:6][cH:7][c:8]([OH:11])[cH:9][cH:10]1)[N+:24]12[CH2:23][CH:22]([O:21][C:19]([CH:18]([c:12]3[cH:13][cH:14][cH:15][cH:16][cH:17]3)[NH:30][c:31]3[cH:32][cH:33][cH:34][cH:35][cH:36]3)=[O:20])[CH:27]([CH2:26][CH2:25]1)[CH2:28][CH2:29]2

Participants

5

Reactant 3

HCID 49642-Bromo-1-(4-hydroxyphenyl)ethanoneHCID 8857Ethyl AcetateHCID 594012151-Azabicyclo[2.2.2]octan-3-yl 2-anilino-2-phenylacetate

Product 2

HCID 259Bromide ionHCID 76828745[1-[2-(4-Hydroxyphenyl)-2-oxoethyl]-1-azoniabicyclo[2.2.2]octan-3-yl] 2-anilino-2-phenylacetate

Sources & evidence

ORD record
ord-f1d1378f89be4c9fa9997be19c9ebee9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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