Sodium ion → HCID 59385322, compound

HRID 1235166Notes

Reaction equation

HRID 1235166 reaction equation
[Br:1][c:2]1[cH:3][c:4]([O:12][CH3:13])[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1.[C:26](=[O:27])([O-:28])[O-:29].[CH2:49]1[O:50][CH2:51][CH2:52][O:53][CH2:54]1.[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47].[Cl:32][CH2:33][Cl:34].[N+:14](=[O:15])([O-:16])[c:17]1[cH:18][cH:19][c:20]([B:23]([OH:24])[OH:25])[cH:21][cH:22]1.[Na+:30].[Na+:31].[OH2:48]>>[c:2]1(-[c:20]2[cH:19][cH:18][c:17]([N+:14](=[O:15])[O-:16])[cH:22][cH:21]2)[cH:3][c:4]([O:12][CH3:13])[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1

Participants

10

Reactant 9

HCID 923Sodium ion2×HCID 962WaterHCID 1140TolueneHCID 6344DichloromethaneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 27735524-Nitrophenylboronic acidHCID 15128242Methyl 4-bromo-2-methoxybenzoate

Product 1

HCID 59385322HCID 59385322, compound

Sources & evidence

ORD record
ord-e9e4ce647b7241398b70a43c3aec0048
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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