Sodium ion → 5-(4-Chloro-phenyl)-2-[4-(2-pyrrolidin-1-yl-ethoxy)-phenylethynyl]-pyridine

HRID 319262Notes

Reaction equation

HRID 319262 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([O:16][CH2:17][CH2:18][N:19]3[CH2:20][CH2:21][CH2:22][CH2:23]3)[cH:14][cH:15]2)[n:6][cH:7]1.[C:35](=[O:36])([O-:37])[O-:38].[CH2:41]1[O:42][CH2:43][CH2:44][O:45][CH2:46]1.[Cl:24][c:25]1[cH:26][cH:27][c:28]([O:31][B:32]([OH:33])[OH:34])[cH:29][cH:30]1.[Na+:39].[Na+:40]>>[c:2]1(-[c:28]2[cH:27][cH:26][c:25]([Cl:24])[cH:30][cH:29]2)[cH:3][cH:4][c:5]([C:8]#[C:9][c:10]2[cH:11][cH:12][c:13]([O:16][CH2:17][CH2:18][N:19]3[CH2:20][CH2:21][CH2:22][CH2:23]3)[cH:14][cH:15]2)[n:6][cH:7]1

Participants

6

Reactant 5

HCID 923Sodium ion2×HCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 17810664p-Chlorophenylboric acidHCID 673653025-Bromo-2-[4-(2-pyrrolidin-1-yl-ethoxy)-phenylethynyl]-pyridine

Product 1

HCID 99784905-(4-Chloro-phenyl)-2-[4-(2-pyrrolidin-1-yl-ethoxy)-phenylethynyl]-pyridine

Sources & evidence

ORD record
ord-e8887eb54b824165bf90c9e1182ef748
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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