Ethanol → HCID 18918975, compound

HRID 194179Notes

Reaction equation

HRID 194179 reaction equation
[C:6]([CH3:7])([CH3:8])([CH3:9])[n:10]1[n:11][cH:12][c:13]([N:18]([CH2:19][CH2:20][CH2:21][OH:22])[CH2:23][c:24]2[cH:25][cH:26][c:27]([C:30]([c:31]3[cH:32][cH:33][c:34]([Cl:37])[cH:35][cH:36]3)=[O:38])[cH:28][cH:29]2)[c:14]([Cl:17])[c:15]1=[O:16].[CH3:2][CH2:3][O-:4].[CH3:39][CH2:40][OH:41].[Na+:1].[Na:5].[OH2:42]>>[C:6]([CH3:7])([CH3:8])([CH3:9])[n:10]1[n:11][cH:12][c:13]2[c:14]([c:15]1=[O:16])[O:22][CH2:21][CH2:20][CH2:19][N:18]2[CH2:23][c:24]1[cH:25][cH:26][c:27]([C:30]([c:31]2[cH:32][cH:33][c:34]([Cl:37])[cH:35][cH:36]2)=[O:38])[cH:28][cH:29]1

Participants

7

Reactant 6

HCID 702EthanolHCID 923Sodium ionHCID 962WaterHCID 1194401-Hydroxyethyl radicalHCID 5360545SodiumHCID 18919096HCID 18919096, compound

Product 1

HCID 18918975HCID 18918975, compound

Sources & evidence

ORD record
ord-1518ef1e77934488b44f5965b09c9627
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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