Water → 4-[1-(4-methoxybenzyl)-3-(3-nitrophenyl)-1H-pyrazol-4-yl]pyridine

HRID 313625

Reaction equation

HRID 313625 reaction equation
[C:40](=[O:41])([O-:42])[O-:43].[CH3:25][C:26]1([CH3:27])[C:28]([CH3:29])([CH3:30])[O:31][B:32]([c:33]2[cH:34][cH:35][n:36][cH:37][cH:38]2)[O:39]1.[Cs+:44].[Cs+:45].[I:1][c:2]1[c:3](-[c:16]2[cH:17][c:18]([N+:22](=[O:23])[O-:24])[cH:19][cH:20][cH:21]2)[n:4][n:5]([CH2:7][c:8]2[cH:9][cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]2)[cH:6]1.[O:46]1[CH2:47][CH2:48][O:49][CH2:50][CH2:51]1.[OH2:52]>>[c:2]1(-[c:33]2[cH:34][cH:35][n:36][cH:37][cH:38]2)[c:3](-[c:16]2[cH:17][c:18]([N+:22](=[O:23])[O-:24])[cH:19][cH:20][cH:21]2)[n:4][n:5]([CH2:7][c:8]2[cH:9][cH:10][c:11]([O:14][CH3:15])[cH:12][cH:13]2)[cH:6]1

Participants

7

Reactant 6

HCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 27346484-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)pyridineHCID 671844834-iodo-1-(4-methoxybenzyl)-3-(3-nitrophenyl)-1H-pyrazole

Product 1

HCID 671847354-[1-(4-methoxybenzyl)-3-(3-nitrophenyl)-1H-pyrazol-4-yl]pyridine

Sources & evidence

ORD record
ord-acc9b58a9aff4119ae2ebce8204cc859
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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