Ammonium → HCID 66600037, compound

HRID 2159372Notes

Reaction equation

HRID 2159372 reaction equation
[C:29](=[O:30])([O-:31])[O-:32].[Cl-:41].[Cl:13][c:14]1[cH:15][n:16][cH:17][cH:18][c:19]1[B:20]1[O:21][C:22]([CH3:23])([CH3:24])[C:25]([CH3:26])([CH3:27])[O:28]1.[Cl:1][c:2]1[cH:3][c:4]([NH:9][C:10]([CH3:11])=[O:12])[n:5][c:6]([CH3:8])[n:7]1.[Cs+:33].[Cs+:34].[NH4+:42].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1.[OH2:43]>>[c:2]1(-[c:19]2[c:14]([Cl:13])[cH:15][n:16][cH:17][cH:18]2)[cH:3][c:4]([NH:9][C:10]([CH3:11])=[O:12])[n:5][c:6]([CH3:8])[n:7]1

Participants

9

Reactant 8

HCID 223AmmoniumHCID 312ChlorideHCID 962WaterHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 243561n-(6-chloro-2-methylpyrimidin-4-yl)acetamideHCID 447551543-Chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine

Product 1

HCID 66600037HCID 66600037, compound

Sources & evidence

ORD record
ord-6df3c2fc440a4bfbb1e26fb868608d1a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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