Acetic Acid → Propanoic acid, 2-((3-(4-chlorophenyl)-1,2-dimethyl-1H-indol-5-yl)oxy)-2-methyl-

HRID 1226034Notes

Reaction equation

HRID 1226034 reaction equation
[CH3:34][C:35](=[O:36])[OH:37].[Cl:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[c:13]([CH3:28])[n:14]([CH3:27])[c:15]3[cH:16][cH:17][c:18]([O:21][C:22]([CH2:23][OH:24])([CH3:25])[CH3:26])[cH:19][c:20]23)[cH:10][cH:11]1.[O:1]=[Cr:2](=[O:3])=[O:4].[OH2:38].[S:29]([OH:30])(=[O:31])(=[O:32])[OH:33]>>[Cl:5][c:6]1[cH:7][cH:8][c:9](-[c:12]2[c:13]([CH3:28])[n:14]([CH3:27])[c:15]3[cH:16][cH:17][c:18]([O:21][C:22]([C:23](=[O:24])[OH:30])([CH3:25])[CH3:26])[cH:19][c:20]23)[cH:10][cH:11]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 962WaterHCID 1118Sulfuric AcidHCID 14915Chromium TrioxideHCID 205291772-[3-(4-chloro-phenyl)-1,2-dimethyl-1H-indole-5-yloxy]-2-methylpropanol

Product 1

HCID 3059432Propanoic acid, 2-((3-(4-chlorophenyl)-1,2-dimethyl-1H-indol-5-yl)oxy)-2-methyl-

Sources & evidence

ORD record
ord-2eab3c0365ab46a79d3df288598da50b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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