Water → HCID 57421271, compound

HRID 2126832Notes

Reaction equation

HRID 2126832 reaction equation
[CH2:25]([CH3:26])[O:27][C:28](=[O:29])[c:30]1[cH:31][cH:32][c:33]([B:36]([OH:37])[OH:38])[cH:34][cH:35]1.[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl:1][c:2]1[c:3]([CH:10]([C:11]([C:12]([F:13])([F:14])[F:15])([OH:16])[c:17]2[cH:18][c:19]([I:23])[n:20][cH:21][cH:22]2)[CH3:24])[cH:4][cH:5][c:6]([O:8][CH3:9])[cH:7]1.[O:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1.[OH2:39]>>[Cl:1][c:2]1[c:3]([CH:10]([C:11]([C:12]([F:13])([F:14])[F:15])([OH:16])[c:17]2[cH:18][c:19](-[c:33]3[cH:32][cH:31][c:30]([C:28]([O:27][CH2:25][CH3:26])=[O:29])[cH:35][cH:34]3)[n:20][cH:21][cH:22]2)[CH3:24])[cH:4][cH:5][c:6]([O:8][CH3:9])[cH:7]1

Participants

6

Reactant 5

HCID 962WaterHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 27343504-Ethoxycarbonylphenylboronic acidHCID 57421270HCID 57421270, compound

Product 1

HCID 57421271HCID 57421271, compound

Sources & evidence

ORD record
ord-21739e4e21eb41f3ac6f0f17fe9b2406
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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