Ethanol → HCID 178446239, compound

Reaction equation

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

Participants

Reactant 4

HCID 702Ethanol

HCID 923Sodium Ion

HCID 961Hydroxide

HCID 178498900HCID 178498900, compound

Product 1

HCID 178446239HCID 178446239, compound

Sources & evidence

ORD record: ord-bd1dab154216459ab23c417803944c06
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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