Potassium Cation → Benzyl ethyl 2-(6-nitro-3-pyridinyl)malonate

HRID 286409Notes

Reaction equation

HRID 286409 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([N+:8](=[O:9])[O-:10])[n:6][cH:7]1.[C:11]([CH2:12][C:13](=[O:14])[O:15][CH2:16][CH3:17])(=[O:18])[O:19][CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1.[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[K+:27].[K+:28].[O-:29][C:30]([O-:31])=[O:32].[O:33]1[CH2:34][CH2:35][CH2:36][CH2:37]1.[OH2:43]>>[c:2]1([CH:12]([C:11](=[O:18])[O:19][CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[C:13](=[O:14])[O:15][CH2:16][CH3:17])[cH:3][cH:4][c:5]([N+:8](=[O:9])[O-:10])[n:6][cH:7]1

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 562228Benzyl ethyl malonateHCID 8176205-Bromo-2-nitropyridine

Product 1

HCID 21875897Benzyl ethyl 2-(6-nitro-3-pyridinyl)malonate

Sources & evidence

ORD record
ord-021197c3e4f0432b8b34908d2b75f13f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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