Bromide ion → 3-{[(2,4-Dichlorobenzyl)-(3-hydroxy-3-methyl-butyl)-amino]-methyl}-azetidine-1-carboxylic acid tert-butyl ester

HRID 180064Notes

Reaction equation

HRID 180064 reaction equation
[Br-:28].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:12][N:13]([CH2:14][CH2:15][C:16]([CH3:17])=[O:18])[CH2:19][c:20]2[c:21]([Cl:27])[cH:22][c:23]([Cl:26])[cH:24][cH:25]2)[CH2:11]1.[CH3:29][Mg+:30].[CH3:31][CH2:32][O:33][CH2:34][CH3:35]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:12][N:13]([CH2:14][CH2:15][C:16]([CH3:17])([OH:18])[CH3:29])[CH2:19][c:20]2[c:21]([Cl:27])[cH:22][c:23]([Cl:26])[cH:24][cH:25]2)[CH2:11]1

Participants

5

Reactant 4

HCID 259Bromide ionHCID 3283Diethyl EtherHCID 690048573-{[(2,4-Dichlorobenzyl)-(3-oxo-butyl)-amino]-methyl}-azetidine-1-carboxylic acid tert-butyl esterHCID 178477777HCID 178477777, compound

Product 1

HCID 690038323-{[(2,4-Dichlorobenzyl)-(3-hydroxy-3-methyl-butyl)-amino]-methyl}-azetidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-8cd7ebaeb7fe46eba39b1135f5dec869
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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