Acetate → 3-(4-Chloro-thiophen-2-yl)-pyridine

HRID 101879Notes

Reaction equation

HRID 101879 reaction equation
[Br:1][c:2]1[s:3][cH:4][c:5]([Cl:7])[cH:6]1.[C:17](=[O:18])([O-:19])[O-:20].[Cl:44][CH2:45][Cl:46].[N:23]#[N:24].[Na+:21].[Na+:22].[O-:48][C:49]([CH3:50])=[O:51].[O-:52][C:53]([CH3:54])=[O:55].[Pd+2:47].[c:25]1([P:26]([c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[c:33]2[cH:34][cH:35][cH:36][cH:37][cH:38]2)[cH:39][cH:40][cH:41][cH:42][cH:43]1.[n:8]1[cH:9][c:10]([B:14]([OH:15])[OH:16])[cH:11][cH:12][cH:13]1>>[c:2]1(-[c:10]2[cH:9][n:8][cH:13][cH:12][cH:11]2)[s:3][cH:4][c:5]([Cl:7])[cH:6]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 923Sodium ion2×HCID 947NitrogenHCID 6344DichloromethaneHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27343783-Pyridinylboronic acidHCID 137808382-Bromo-4-chlorothiophene

Product 1

HCID 688427283-(4-Chloro-thiophen-2-yl)-pyridine

Sources & evidence

ORD record
ord-38ba60d5d75046048deb8dac852f0e99
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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