Ethanol → HCID 18523413, compound

HRID 1225460Notes

Reaction equation

HRID 1225460 reaction equation
[CH3:42][CH2:43][OH:44].[F:3][c:4]1[c:5]([N:25]2[CH2:26][CH2:27][C:28]([c:31]3[cH:32][c:33]([C:37]([F:38])([F:39])[F:40])[cH:34][cH:35][cH:36]3)([OH:41])[CH2:29][CH2:30]2)[c:6]2[c:7]([c:8]3[c:9](=[O:22])[c:10]([C:17](=[O:18])[O:19][CH2:20][CH3:21])[cH:11][n:12]([CH3:16])[c:13]3[cH:14][n:15]2)[cH:23][cH:24]1.[K+:2].[OH-:1].[OH2:45]>>[F:3][c:4]1[c:5]([N:25]2[CH2:26][CH2:27][C:28]([c:31]3[cH:32][c:33]([C:37]([F:38])([F:39])[F:40])[cH:34][cH:35][cH:36]3)([OH:41])[CH2:29][CH2:30]2)[c:6]2[c:7]([c:8]3[c:9](=[O:22])[c:10]([C:17](=[O:18])[OH:19])[cH:11][n:12]([CH3:16])[c:13]3[cH:14][n:15]2)[cH:23][cH:24]1

Participants

6

Reactant 5

HCID 702EthanolHCID 813Potassium CationHCID 961HydroxideHCID 962WaterHCID 18523244HCID 18523244, compound

Product 1

HCID 18523413HCID 18523413, compound

Sources & evidence

ORD record
ord-29f4c3ee75044c5f85aa880f199359e2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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