Benzene, (3-bromopropoxy)- → Bromide ion

HRID 299568Notes

Reaction equation

HRID 299568 reaction equation
[N:1]12[CH2:2][CH2:3][C:4]([C:9]([OH:10])([c:11]3[cH:12][c:13]([O:17][CH3:18])[cH:14][cH:15][cH:16]3)[c:19]3[cH:20][c:21]([O:25][CH3:26])[cH:22][cH:23][cH:24]3)([CH2:5][CH2:6]1)[CH2:7][CH2:8]2.[c:27]1([O:33][CH2:34][CH2:35][CH2:36][Br:37])[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[Br-:37].[N+:1]12([CH2:36][CH2:35][CH2:34][O:33][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)[CH2:2][CH2:3][C:4]([C:9]([OH:10])([c:11]3[cH:12][c:13]([O:17][CH3:18])[cH:14][cH:15][cH:16]3)[c:19]3[cH:20][c:21]([O:25][CH3:26])[cH:22][cH:23][cH:24]3)([CH2:5][CH2:6]1)[CH2:7][CH2:8]2

Participants

4

Reactant 2

HCID 68522Benzene, (3-bromopropoxy)-HCID 689576291-Azabicyclo[2.2.2]oct-4-yl{bis[3-(methyloxy)phenyl]}methanol

Product 2

HCID 259Bromide ionHCID 11706818Bis(3-methoxyphenyl)-[1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octan-4-yl]methanol

Sources & evidence

ORD record
ord-dea0aca436444a9db7be94c2ef1c2d53
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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