Water → HCID 58046368, compound

HRID 1147170Notes

Reaction equation

HRID 1147170 reaction equation
[C:41](=[O:42])([O-:43])[O-:44].[CH3:13][c:14]1[cH:15][cH:16][c:17]([S:20](=[O:21])(=[O:22])[n:23]2[cH:24][cH:25][c:26]3[c:27]2[n:28][cH:29][cH:30][c:31]3[B:32]2[O:33][C:34]([CH3:35])([CH3:36])[C:37]([CH3:38])([CH3:39])[O:40]2)[cH:18][cH:19]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([n:7]1)[c:8]([I:12])[c:9]([CH3:11])[n:10]2.[Cl:53][CH2:54][Cl:55].[Cs+:45].[Cs+:46].[O:47]1[CH2:48][CH2:49][CH2:50][CH2:51]1.[OH2:52]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[n:6]([n:7]1)[c:8](-[c:31]1[c:26]3[cH:25][cH:24][n:23]([S:20]([c:17]4[cH:16][cH:15][c:14]([CH3:13])[cH:19][cH:18]4)(=[O:21])=[O:22])[c:27]3[n:28][cH:29][cH:30]1)[c:9]([CH3:11])[n:10]2

Participants

8

Reactant 7

HCID 962WaterHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 469416436-Chloro-3-iodo-2-methylimidazo[1,2-b]pyridazineHCID 497589261-Tosyl-1H-pyrrolo(2,3-B)pyridine-4-boronic acid pinacol ester

Product 1

HCID 58046368HCID 58046368, compound

Sources & evidence

ORD record
ord-a88ce1389c9f46788977972b4c928acd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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