Bromide ion → (+-)-1-(tert-Butoxycarbonyl)pyrrolidine-3-carboxaldehyde

HRID 1113320Notes

Reaction equation

HRID 1113320 reaction equation
[Br-:27].[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH2:13][OH:14])[CH2:11][CH2:12]1.[CH3:15][C:16]1([CH3:25])[N:17]([O:18])[C:19]([CH3:20])([CH3:21])[CH2:22][CH2:23][CH2:24]1.[Cl:28][O-:29].[Cl:37][CH2:38][Cl:39].[K+:26].[Na+:30].[Na+:36].[O-:32][C:33]([OH:34])=[O:35].[OH2:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH:10]([CH:13]=[O:14])[CH2:11][CH2:12]1

Participants

10

Reactant 9

HCID 259Bromide ionHCID 769Bicarbonate IonHCID 813Potassium CationHCID 923Sodium ion2×HCID 962WaterHCID 6344DichloromethaneHCID 61739HypochloriteHCID 5499762,2,6,6-Tetramethylpiperidin-1-olHCID 5237175tert-Butyl 3-(hydroxymethyl)pyrrolidine-1-carboxylate

Product 1

HCID 4692112(+-)-1-(tert-Butoxycarbonyl)pyrrolidine-3-carboxaldehyde

Sources & evidence

ORD record
ord-af55c2724f21484693a17dfc90f95063
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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