Ethanol → HCID 21109646, compound

HRID 296309Notes

Reaction equation

HRID 296309 reaction equation
[C:36](=[O:37])([O-:38])[O-:39].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[n:10][cH:11][c:12]([C:13](=[O:14])[NH:15][CH:16]2[CH:17]([OH:22])[CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:23][c:24]1[Br:25].[CH3:42][O:43][CH2:44][CH2:45][O:46][CH3:47].[CH3:48][CH2:49][OH:50].[Cl:26][c:27]1[cH:28][cH:29][c:30]([B:33]([OH:34])[OH:35])[cH:31][cH:32]1.[Na+:40].[Na+:41].[OH2:51]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[n:10][cH:11][c:12]([C:13](=[O:14])[NH:15][CH:16]2[CH:17]([OH:22])[CH2:18][CH2:19][CH2:20][CH2:21]2)[cH:23][c:24]1-[c:30]1[cH:29][cH:28][c:27]([Cl:26])[cH:32][cH:31]1

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 742994-Chlorophenylboronic acidHCID 21109716HCID 21109716, compound

Product 1

HCID 21109646HCID 21109646, compound

Sources & evidence

ORD record
ord-2f61118fa5104aea8e87650bd275cd17
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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