Ethanol → HCID 54464286, compound

HRID 193185

Reaction equation

HRID 193185 reaction equation
[CH3:12][CH2:13][O:14][C:15](=[O:16])[CH2:17][P:18]([O:19][CH2:20][CH3:21])([O:22][CH2:23][CH3:24])=[O:25].[CH3:26][CH2:27][O-:28].[CH3:30][CH2:31][OH:32].[CH3:33][CH2:34][OH:35].[Na+:29].[s:1]1[c:2]2[c:3]([cH:4][c:5]1[CH:6]=[O:7])[cH:8][cH:9][cH:10][cH:11]2>>[s:1]1[c:2]2[c:3]([cH:4][c:5]1[CH:6]=[CH:17][C:15]([O:14][CH2:13][CH3:12])=[O:16])[cH:8][cH:9][cH:10][cH:11]2

Participants

6

Reactant 5

HCID 702Ethanol2×HCID 923Sodium ionHCID 13345Triethyl phosphonoacetateHCID 1194401-Hydroxyethyl radicalHCID 7365001-Benzothiophene-2-carbaldehyde

Product 1

HCID 54464286HCID 54464286, compound

Sources & evidence

ORD record
ord-114634105ab74deaad7f7b6be973e694
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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