Acetic Acid → tert-Butyl 4-(2-oxoethyl)piperidine-1-carboxylate

HRID 1538007Notes

Reaction equation

HRID 1538007 reaction equation
[C:28]([OH:29])(=[O:30])[CH3:31].[C:32]([OH:33])(=[O:34])[CH3:35].[CH3:17][C:18]1([CH3:27])[N:19]([O:20])[C:21]([CH3:22])([CH3:23])[CH2:24][CH2:25][CH2:26]1.[Cl:50][CH2:51][Cl:52].[I:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[Na+:43].[Na+:44].[O-:45][S:46]([O-:47])(=[S:48])=[O:49].[OH:1][CH2:2][CH2:3][CH:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[CH2:8][CH2:9]1>>[O:1]=[CH:2][CH2:3][CH:4]1[CH2:5][CH2:6][N:7]([C:10](=[O:11])[O:12][C:13]([CH3:14])([CH3:15])[CH3:16])[CH2:8][CH2:9]1

Participants

8

Reactant 7

HCID 176Acetic Acid2×HCID 923Sodium ion2×HCID 1084Thiosulfate ionHCID 6344DichloromethaneHCID 11575IodobenzeneHCID 5499762,2,6,6-Tetramethylpiperidin-1-olHCID 8541401-(tert-Butoxycarbonyl)-4-(2-hydroxyethyl)piperidine

Product 1

HCID 10353694tert-Butyl 4-(2-oxoethyl)piperidine-1-carboxylate

Sources & evidence

ORD record
ord-88ca495fa36f4431b1f3bb41fd0116ab
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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