Potassium Cation → Methyl 4-methoxy-2-(1H-pyrazol-1-yl)butanoate

HRID 122310Notes

Reaction equation

HRID 122310 reaction equation
[Br:25][N:26]1[C:27](=[O:28])[CH2:29][CH2:30][C:31]1=[O:32].[C:33](=[O:34])([O-:35])[O-:36].[CH2:44]1[O:45][CH2:46][CH2:47][CH2:48]1.[CH3:11][Si:12]([N-:13][Si:14]([CH3:15])([CH3:16])[CH3:17])([CH3:18])[CH3:19].[CH3:1][O:2][CH2:3][CH2:4][CH2:5][C:6](=[O:7])[O:8][CH3:9].[Cl:20][Si:21]([CH3:22])([CH3:23])[CH3:24].[K+:37].[K+:38].[Li+:10].[OH2:49].[nH:39]1[n:40][cH:41][cH:42][cH:43]1>>[CH3:1][O:2][CH2:3][CH2:4][CH:5]([C:6](=[O:7])[O:8][CH3:9])[n:39]1[n:40][cH:41][cH:42][cH:43]1

Participants

11

Reactant 10

HCID 813Potassium Cation2×HCID 962WaterHCID 1048PyrazoleHCID 6397ChlorotrimethylsilaneHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 28486Lithium ionHCID 67184N-bromobutanimideHCID 542317Methyl 4-methoxybutanoateHCID 3280088Npc316347

Product 1

HCID 66839386Methyl 4-methoxy-2-(1H-pyrazol-1-yl)butanoate

Sources & evidence

ORD record
ord-d713c46cd3cd4d2cb6229661deff8974
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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