Ethanol → HCID 24752739, compound

HRID 140057Notes

Reaction equation

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

Participants

Reactant 4

HCID 702Ethanol

HCID 923Sodium ion

HCID 961Hydroxide

HCID 67157848(4-{3-[3-Bromo-5-(3-morpholin-4-yl-prop-1-ynyl)-phenyl]-prop-2-ynyloxy}-2-methylphenoxy)-acetic acid methyl ester

Product 1

HCID 24752739HCID 24752739, compound

Sources & evidence

ORD record: ord-36f9dc7547824fc7b6d9dc341e2752f1
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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