Sodium ion → HCID 178470619, compound

HRID 169557Notes

Reaction equation

HRID 169557 reaction equation
[C:41](=[O:42])([O-:43])[O-:44].[CH2:54]1[O:55][CH2:56][CH2:57][O:58][CH2:59]1.[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([B:9]([OH:10])[OH:11])[cH:7][cH:8]1.[CH3:47][c:48]1[cH:49][cH:50][cH:51][cH:52][cH:53]1.[Cl:12][c:13]1[n:14][cH:15][c:16]([Cl:40])[c:17]([N:19]([CH2:20][CH2:21][CH2:22][O:23][c:24]2[cH:25][c:26]3[c:30]([cH:31][cH:32]2)[CH:29]([CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38])[CH2:28][CH2:27]3)[CH3:39])[n:18]1.[Na+:45].[Na+:46]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6](-[c:16]2[cH:15][n:14][c:13]([Cl:12])[n:18][c:17]2[N:19]([CH2:20][CH2:21][CH2:22][O:23][c:24]2[cH:25][c:26]3[c:30]([cH:31][cH:32]2)[CH:29]([CH2:33][C:34](=[O:35])[O:36][CH2:37][CH3:38])[CH2:28][CH2:27]3)[CH3:39])[cH:7][cH:8]1

Participants

7

Reactant 6

HCID 923Sodium ion2×HCID 1140TolueneHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 201262(4-Methoxyphenyl)boronic acidHCID 178470621HCID 178470621, compound

Product 1

HCID 178470619HCID 178470619, compound

Sources & evidence

ORD record
ord-d67faa368bf24b6bbd6f655e87223bb7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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