Ethanol → HCID 20094536, compound

HRID 2324095Notes

Reaction equation

HRID 2324095 reaction equation
[CH2:6]([CH2:7][CH2:8][CH3:9])[c:10]1[n:11]([CH2:18][c:19]2[cH:20][c:21]3[c:22]([Br:39])[n:23](-[c:28]4[c:29]([C:34](=[O:35])[O:36][CH2:37][CH3:38])[cH:30][cH:31][cH:32][cH:33]4)[n:24][c:25]3[cH:26][cH:27]2)[c:12]([CH:16]=[O:17])[c:13]([Cl:15])[n:14]1.[CH3:1][CH2:2][OH:3].[K+:5].[OH-:4].[OH2:40]>>[CH2:6]([CH2:7][CH2:8][CH3:9])[c:10]1[n:11]([CH2:18][c:19]2[cH:20][c:21]3[c:22]([Br:39])[n:23](-[c:28]4[c:29]([C:34](=[O:35])[OH:36])[cH:30][cH:31][cH:32][cH:33]4)[n:24][c:25]3[cH:26][cH:27]2)[c:12]([CH:16]=[O:17])[c:13]([Cl:15])[n:14]1

Participants

6

Reactant 5

HCID 702EthanolHCID 813Potassium CationHCID 961HydroxideHCID 962WaterHCID 20094534HCID 20094534, compound

Product 1

HCID 20094536HCID 20094536, compound

Sources & evidence

ORD record
ord-a805f6c878284984bc48e4018caff7b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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