Acetate → 4-(2-(4-Benzyl-2-fluoropyridin-3-yl)ethoxy)-7-methoxyquinoline

HRID 1144046Notes

Reaction equation

HRID 1144046 reaction equation
[C:8](=[O:9])([O-:10])[O-:11].[CH2:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[c:34]1[c:35]([CH2:41][CH2:42][OH:43])[c:36]([F:40])[n:37][cH:38][cH:39]1.[CH3:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[Cs+:12].[Cs+:13].[I:14][c:15]1[cH:16][cH:17][n:18][c:19]2[cH:20][c:21]([O:25][CH3:26])[cH:22][cH:23][c:24]12.[O-:45][C:46]([CH3:47])=[O:48].[O-:49][C:50]([CH3:51])=[O:52].[OH2:53].[Pd+2:44]>>[c:15]1([O:43][CH2:42][CH2:41][c:35]2[c:34]([CH2:27][c:28]3[cH:29][cH:30][cH:31][cH:32][cH:33]3)[cH:39][cH:38][n:37][c:36]2[F:40])[cH:16][cH:17][n:18][c:19]2[cH:20][c:21]([O:25][CH3:26])[cH:22][cH:23][c:24]12

Participants

9

Reactant 8

HCID 175Acetate2×HCID 962WaterHCID 1140TolueneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 177506514-Iodo-7-methoxyquinolineHCID 688094722-(4-Benzyl-2-fluoropyridin-3-yl)ethanol

Product 1

HCID 688105894-(2-(4-Benzyl-2-fluoropyridin-3-yl)ethoxy)-7-methoxyquinoline

Sources & evidence

ORD record
ord-0248cf2542b348c5bd549cbe00b9fc79
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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