Sodium ion → 3-Nitro-4-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)pyridine

HRID 679628Notes

Reaction equation

HRID 679628 reaction equation
[CH3:1][O:2][CH2:3][CH2:4][O:5][CH3:6].[CH3:23][C:24]1([CH3:25])[C:26]([CH3:27])([CH3:28])[O:29][B:30]([C:31]2=[CH:32][CH2:33][C:34]3([O:35][CH2:36][CH2:37][O:38]3)[CH2:39][CH2:40]2)[O:41]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl:13][c:14]1[c:15]([N+:20](=[O:21])[O-:22])[cH:16][n:17][cH:18][cH:19]1.[Na+:7].[Na+:8].[O-:9][C:10](=[O:11])[O-:12]>>[c:14]1([C:31]2=[CH:32][CH2:33][C:34]3([O:35][CH2:36][CH2:37][O:38]3)[CH2:39][CH2:40]2)[c:15]([N+:20](=[O:21])[O-:22])[cH:16][n:17][cH:18][cH:19]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 27357814-Chloro-3-nitropyridineHCID 36970768-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-1,4-dioxaspiro(4.5)dec-7-ene

Product 1

HCID 592265423-Nitro-4-(1,4-dioxaspiro[4.5]dec-7-en-8-yl)pyridine

Sources & evidence

ORD record
ord-44753d2ee5a6424a9e42bdd51a6b33aa
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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