Ethanol → HCID 22329002, compound

HRID 1216863Notes

Reaction equation

HRID 1216863 reaction equation
[B:24]([O-:25])([O-:40])[O:41][c:26]1[cH:27][cH:28][c:29]([O:32][CH2:33][CH2:34][O:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:30][cH:31]1.[Br:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:23]1)[CH:7]=[C:8]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:9][CH2:10][N:11]2[CH2:12][CH2:13][O:14][CH3:15].[C:42](=[O:43])([O-:44])[O-:45].[CH2:50]([OH:51])[CH3:52].[K+:46].[K+:47].[OH2:48].[OH2:49].[c:53]1([CH3:54])[cH:55][cH:56][cH:57][cH:58][cH:59]1>>[c:2]1(-[c:26]2[cH:27][cH:28][c:29]([O:32][CH2:33][CH2:34][O:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:30][cH:31]2)[cH:3][cH:4][c:5]2[c:6]([cH:23]1)[CH:7]=[C:8]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:9][CH2:10][N:11]2[CH2:12][CH2:13][O:14][CH3:15]

Participants

8

Reactant 7

HCID 702EthanolHCID 813Potassium Cation2×HCID 962Water2×HCID 1140TolueneHCID 19660Carbonate IonHCID 22328995HCID 22328995, compoundHCID 867568154-Butoxyethoxyphenyl borate

Product 1

HCID 22329002HCID 22329002, compound

Sources & evidence

ORD record
ord-32d5a724f83c496787d08ba6de953594
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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