Ethanol → HCID 46186809, compound

HRID 120484Notes

Reaction equation

HRID 120484 reaction equation
[CH2:3]([CH3:4])[O:5][C:6](=[O:7])[C:8]1([CH2:22][O:23][c:24]2[cH:25][cH:26][c:27](-[c:30]3[cH:31][cH:32][c:33]([C:36]#[N:37])[cH:34][cH:35]3)[cH:28][cH:29]2)[CH2:9][N:10]([C:13]([c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)=[O:21])[CH2:11][CH2:12]1.[CH3:38][CH2:39][OH:40].[Li+:1].[OH-:2].[OH2:41]>>[O:5]=[C:6]([OH:7])[C:8]1([CH2:22][O:23][c:24]2[cH:25][cH:26][c:27](-[c:30]3[cH:31][cH:32][c:33]([C:36]#[N:37])[cH:34][cH:35]3)[cH:28][cH:29]2)[CH2:9][N:10]([C:13]([c:14]2[cH:15][cH:16][c:17]([F:20])[cH:18][cH:19]2)=[O:21])[CH2:11][CH2:12]1

Participants

6

Reactant 5

HCID 702EthanolHCID 961HydroxideHCID 962WaterHCID 28486Lithium ionHCID 59322207HCID 59322207, compound

Product 1

HCID 46186809HCID 46186809, compound

Sources & evidence

ORD record
ord-fda0310b63c04216837277e24fcbeb8e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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