Benzene, (2-bromoethoxy)- → Bromide ion

HRID 99522

Reaction equation

HRID 99522 reaction equation
[N:1]12[CH2:2][CH2:3][C:4]([C:9]([OH:10])([c:11]3[s:12][cH:13][cH:14][cH:15]3)[c:16]3[s:17][cH:18][cH:19][cH:20]3)([CH2:5][CH2:6]1)[CH2:7][CH2:8]2.[c:21]1([O:27][CH2:28][CH2:29][Br:30])[cH:22][cH:23][cH:24][cH:25][cH:26]1>>[Br-:30].[N+:1]12([CH2:29][CH2:28][O:27][c:21]3[cH:22][cH:23][cH:24][cH:25][cH:26]3)[CH2:2][CH2:3][C:4]([C:9]([OH:10])([c:11]3[s:12][cH:13][cH:14][cH:15]3)[c:16]3[s:17][cH:18][cH:19][cH:20]3)([CH2:5][CH2:6]1)[CH2:7][CH2:8]2

Participants

4

Reactant 2

HCID 68526Benzene, (2-bromoethoxy)-HCID 688655991-Azabicyclo[2.2.2]oct-4-yl(di-2-thienyl)methanol

Product 2

HCID 259Bromide ionHCID 11713140[1-(2-Phenoxyethyl)-1-azoniabicyclo[2.2.2]octan-4-yl]-dithiophen-2-ylmethanol

Sources & evidence

ORD record
ord-bf9f8e28a1184d8bb5858f22c1953758
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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