Ethyl Acetate → Bromide ion

HRID 209219Notes

Reaction equation

HRID 209219 reaction equation
[Br:28][CH2:29][CH2:30][c:31]1[cH:32][cH:33][c:34]2[c:35]([cH:39]1)[CH2:36][CH2:37][O:38]2.[CH3:40][CH2:41][O:42][C:43](=[O:44])[CH3:45].[N:1]12[CH2:2][CH:3]([NH:9][C:10]([O:11][CH:12]([c:13]3[cH:14][c:15]([F:19])[cH:16][cH:17][cH:18]3)[c:20]3[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]3)=[O:27])[CH:4]([CH2:5][CH2:6]1)[CH2:7][CH2:8]2>>[Br-:28].[N+:1]12([CH2:29][CH2:30][c:31]3[cH:32][cH:33][c:34]4[c:35]([cH:39]3)[CH2:36][CH2:37][O:38]4)[CH2:2][CH:3]([NH:9][C:10]([O:11][CH:12]([c:13]3[cH:14][c:15]([F:19])[cH:16][cH:17][cH:18]3)[c:20]3[cH:21][c:22]([F:26])[cH:23][cH:24][cH:25]3)=[O:27])[CH:4]([CH2:5][CH2:6]1)[CH2:7][CH2:8]2

Participants

5

Reactant 3

HCID 8857Ethyl AcetateHCID 218311605-(2-Bromoethyl)-2,3-dihydro-1-benzofuranHCID 70925809bis(3-fluorophenyl)methyl N-(1-azabicyclo[2.2.2]octan-3-yl)carbamate

Product 2

HCID 259Bromide ionHCID 70925757HCID 70925757, compound

Sources & evidence

ORD record
ord-18219b18343e460fa85357579eb172c7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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