Water → HCID 57995562, compound

HRID 309362Notes

Reaction equation

HRID 309362 reaction equation
[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[CH3:44][O:45][CH2:46][CH2:47][O:48][CH3:49].[Cl:1][c:2]1[cH:3][c:4]([C:15]2([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:16][CH2:17][CH2:18]2)[cH:5][c:6]([O:9][CH2:10][C:11]([F:12])([F:13])[F:14])[c:7]1[I:8].[F:24][C:25]([c:26]1[cH:27][cH:28][c:29]([B:32]([OH:33])[OH:34])[cH:30][cH:31]1)([F:35])[F:36].[OH2:43]>>[Cl:1][c:2]1[cH:3][c:4]([C:15]2([C:19](=[O:20])[O:21][CH2:22][CH3:23])[CH2:16][CH2:17][CH2:18]2)[cH:5][c:6]([O:9][CH2:10][C:11]([F:12])([F:13])[F:14])[c:7]1-[c:29]1[cH:28][cH:27][c:26]([C:25]([F:24])([F:35])[F:36])[cH:31][cH:30]1

Participants

6

Reactant 5

HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 8857Ethyl AcetateHCID 27343894-(Trifluoromethyl)phenylboronic acidHCID 57995621HCID 57995621, compound

Product 1

HCID 57995562HCID 57995562, compound

Sources & evidence

ORD record
ord-5be9b77b8dd54aa2a1363b5de6ba7a47
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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