Sodium ion → HCID 54272216, compound

HRID 289090Notes

Reaction equation

HRID 289090 reaction equation
[C:29]([CH2:30][C:31](=[O:32])[CH3:33])(=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39].[CH2:42]([Li:43])[CH2:44][CH2:45][CH3:46].[F:1][c:2]1[cH:3][c:4]([CH3:28])[c:5]([C:8](=[C:9]([CH:10]=[CH:11][CH:12]=[O:13])[c:14]2[n:15][n:16][n:17][n:18]2[CH3:19])[c:20]2[c:21]([CH3:27])[cH:22][c:23]([F:26])[cH:24][cH:25]2)[cH:6][cH:7]1.[H-:40].[Na+:41].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1>>[F:1][c:2]1[cH:3][c:4]([CH3:28])[c:5]([C:8](=[C:9]([CH:10]=[CH:11][CH:12]([OH:13])[CH2:33][C:31]([CH2:30][C:29](=[O:34])[O:35][C:36]([CH3:37])([CH3:38])[CH3:39])=[O:32])[c:14]2[n:15][n:16][n:17][n:18]2[CH3:19])[c:20]2[c:21]([CH3:27])[cH:22][c:23]([F:26])[cH:24][cH:25]2)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 923Sodium ionHCID 8028TetrahydrofuranHCID 15538Tert-butyl acetoacetateHCID 166653HydrideHCID 53912652HCID 53912652, compoundHCID 178418339Butyllithium

Product 1

HCID 54272216HCID 54272216, compound

Sources & evidence

ORD record
ord-80c4216d89bb4dad96bc4e086058fb3d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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