Ethanol → HCID 74422682, compound

HRID 1209564Notes

Reaction equation

HRID 1209564 reaction equation
[CH2:38]1[O:39][CH2:40][CH2:41][CH2:42]1.[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:20][O:21][c:22]2[cH:23][cH:24][c:25]([CH:28]([CH2:29][C:30](=[O:31])[O:32][CH3:33])[C:34]#[C:35][CH2:36][CH3:37])[cH:26][cH:27]2)[cH:9][c:10]1-[c:11]1[c:12]([F:19])[cH:13][cH:14][c:15]([O:17][CH3:18])[cH:16]1.[CH3:43][CH2:44][OH:45].[Na+:47].[OH-:46]>>[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[cH:6][cH:7][c:8]([CH2:20][O:21][c:22]2[cH:23][cH:24][c:25]([CH:28]([CH2:29][C:30](=[O:31])[OH:32])[C:34]#[C:35][CH2:36][CH3:37])[cH:26][cH:27]2)[cH:9][c:10]1-[c:11]1[c:12]([F:19])[cH:13][cH:14][c:15]([O:17][CH3:18])[cH:16]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 8028TetrahydrofuranHCID 178444191HCID 178444191, compound

Product 1

HCID 74422682HCID 74422682, compound

Sources & evidence

ORD record
ord-f61461d091954d8498c29fd066c3e84c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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