Acetone → HCID 21891474, compound

HRID 180739Notes

Reaction equation

HRID 180739 reaction equation
[Br-:27].[Br-:37].[CH3:38][C:39](=[O:40])[CH3:41].[CH3:42][N:43]([CH3:44])[CH:45]=[O:46].[Cl:1][CH2:2][CH2:3][CH2:4][CH2:5][N:6]1[C:7](=[O:25])[c:8]2[c:9]([c:12]([C:23]#[N:24])[n:13][n:14]2-[c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[CH2:10][CH2:11]1.[H-:35].[K+:26].[NH:28]1[C:29](=[O:34])[CH2:30][CH2:31][CH2:32][CH2:33]1.[Na+:36]>>[CH2:2]([CH2:3][CH2:4][CH2:5][N:6]1[C:7](=[O:25])[c:8]2[c:9]([c:12]([C:23]#[N:24])[n:13][n:14]2-[c:15]2[cH:16][cH:17][c:18]([O:21][CH3:22])[cH:19][cH:20]2)[CH2:10][CH2:11]1)[N:28]1[C:29](=[O:34])[CH2:30][CH2:31][CH2:32][CH2:33]1

Participants

9

Reactant 8

HCID 180AcetoneHCID 259Bromide ion2×HCID 813Potassium CationHCID 923Sodium ionHCID 6228DimethylformamideHCID 126652-PiperidoneHCID 166653HydrideHCID 21891477HCID 21891477, compound

Product 1

HCID 21891474HCID 21891474, compound

Sources & evidence

ORD record
ord-23c5de11bd7a4bd0a1d50f8028540d94
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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