Ethanol → HCID 53643235, compound

HRID 2347502Notes

Reaction equation

HRID 2347502 reaction equation
[B:13]([O-:14])([O-:25])[O:26][c:15]1[cH:16][cH:17][c:18]([C:21]([CH3:22])([CH3:23])[CH3:24])[cH:19][cH:20]1.[Br:1][c:2]1[cH:3][cH:4][c:5]([CH:7]=[CH:8][C:9](=[O:10])[O:11][CH3:12])[s:6]1.[C:27](=[O:28])([O-:29])[O-:30].[CH2:40]([OH:41])[CH3:42].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[K+:31].[K+:32].[OH2:39].[c:43]1([CH3:44])[cH:45][cH:46][cH:47][cH:48][cH:49]1>>[c:2]1(-[c:15]2[cH:16][cH:17][c:18]([C:21]([CH3:22])([CH3:23])[CH3:24])[cH:19][cH:20]2)[cH:3][cH:4][c:5]([CH:7]=[CH:8][C:9](=[O:10])[O:11][CH3:12])[s:6]1

Participants

9

Reactant 8

HCID 702EthanolHCID 813Potassium Cation2×HCID 962WaterHCID 1140TolueneHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 53396028HCID 53396028, compoundHCID 867561654-Tert-butylphenyl borate

Product 1

HCID 53643235HCID 53643235, compound

Sources & evidence

ORD record
ord-9116b35fc1d743ec8448a091bf21ae28
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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