Bromide ion → 5-[(3-Chloropyridin-4-yl)(2,5-difluorophenyl)methylsulfonyl]-2-fluoropyridine

HRID 2127441Notes

Reaction equation

HRID 2127441 reaction equation
[Br-:38].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[CH3:64][C:65]#[N:66].[Cl:29][CH2:30][Cl:31].[Cl:3][c:4]1[n:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[CH:13]([c:14]2[c:15]([F:21])[cH:16][cH:17][c:18]([F:20])[cH:19]2)[c:22]2[c:23]([Cl:28])[cH:24][n:25][cH:26][cH:27]2)[cH:8][cH:9]1.[F-:1].[K+:2].[c:39]1([P+:40]([c:41]2[cH:42][cH:43][cH:44][cH:45][cH:46]2)([c:47]2[cH:48][cH:49][cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[cH:59][cH:60][cH:61][cH:62][cH:63]1>>[F:1][c:4]1[n:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[CH:13]([c:14]2[c:15]([F:21])[cH:16][cH:17][c:18]([F:20])[cH:19]2)[c:22]2[c:23]([Cl:28])[cH:24][n:25][cH:26][cH:27]2)[cH:8][cH:9]1

Participants

9

Reactant 8

HCID 259Bromide ionHCID 813Potassium CationHCID 6342AcetonitrileHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 28179Fluoride IonHCID 164912TetraphenylphosphoniumHCID 23114670HCID 23114670, compound

Product 1

HCID 597507955-[(3-Chloropyridin-4-yl)(2,5-difluorophenyl)methylsulfonyl]-2-fluoropyridine

Sources & evidence

ORD record
ord-fe28df3d11984c65b256e97405252913
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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