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Acetone → [4-Acetyl-3-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentyloxy]-2-propylphenoxy]acetic acid ethyl ester

HRID 1539485
Notes
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Reaction equation

HRID 1539485 reaction equation
[C:41](=[O:42])([O-:43])[O-:44].[CH2:15]([CH3:16])[O:17][C:18]([CH2:19][O:20][c:21]1[c:22]([CH2:37][CH2:38][CH3:39])[c:23]([O:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][Br:36])[c:24]([C:27]([CH3:28])=[O:29])[cH:25][cH:26]1)=[O:40].[CH3:47][C:48](=[O:49])[CH3:50].[CH3:51][N:52]([CH3:53])[CH:54]=[O:55].[K+:45].[K+:46].[OH:1][c:2]1[c:3]([C:12]([CH3:13])=[O:14])[cH:4][cH:5][c:6]([OH:11])[c:7]1[CH2:8][CH2:9][CH3:10]>>[OH:1][c:2]1[c:3]([C:12]([CH3:13])=[O:14])[cH:4][cH:5][c:6]([O:11][CH2:35][CH2:34][CH2:33][CH2:32][CH2:31][O:30][c:23]2[c:22]([CH2:37][CH2:38][CH3:39])[c:21]([O:20][CH2:19][C:18]([O:17][CH2:15][CH3:16])=[O:40])[cH:26][cH:25][c:24]2[C:27]([CH3:28])=[O:29])[c:7]1[CH2:8][CH2:9][CH3:10]
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 180AcetoneHCID 813Potassium Cation2×HCID 6228DimethylformamideHCID 19660Carbonate IonHCID 27751982',4'-Dihydroxy-3'-propylacetophenoneHCID 14330003[4-Acetyl-3-[(5-bromopentyl)oxy]-2-propylphenoxy]acetic acid ethyl ester

Product 1

HCID 14329974
[4-Acetyl-3-[5-(4-acetyl-3-hydroxy-2-propylphenoxy)pentyloxy]-2-propylphenoxy]acetic acid ethyl ester

Sources & evidence

ORD record
ord-274ef4980d004a308848a7edead9fcb4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes