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Ethanol → Isoxepac

HRID 307889
Notes
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Reaction equation

HRID 307889 reaction equation
[C:4](=[O:5])([OH:6])[c:7]1[c:8]([CH2:9][O:10][c:11]2[cH:12][cH:13][c:14]([CH2:17][C:18](=[O:19])[OH:20])[cH:15][cH:16]2)[cH:21][cH:22][cH:23][cH:24]1.[CH3:1][CH2:2][OH:3].[Na+:26].[OH-:25].[OH2:27]>>[C:4]1(=[O:6])[c:7]2[c:8]([cH:21][cH:22][cH:23][cH:24]2)[CH2:9][O:10][c:11]2[c:12]1[cH:13][c:14]([CH2:17][C:18](=[O:19])[OH:20])[cH:15][cH:16]2
ParticipantsSources & evidenceReaction notes

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 122923092-((4-Carboxymethylphenoxy)methyl)benzoic acid

Product 1

HCID 41448Isoxepac

Sources & evidence

ORD record
ord-3b843a1ba8734710a644d2edd6984208
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes