Acetic Acid → 4-(1,3-Dioxoisoindolin-2-yl)-1-methylcyclohexanecarboxylic acid

HRID 2316997Notes

Reaction equation

HRID 2316997 reaction equation
[CH3:25][C:26](=[O:27])[OH:28].[ClH:24].[O:1]=[C:2]1[N:3]([CH:12]2[CH2:13][CH2:14][C:15]([C:18](=[O:19])[O:20][CH2:21][CH3:22])([CH3:23])[CH2:16][CH2:17]2)[C:4](=[O:11])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21>>[O:1]=[C:2]1[N:3]([CH:12]2[CH2:13][CH2:14][C:15]([C:18](=[O:19])[OH:20])([CH3:23])[CH2:16][CH2:17]2)[C:4](=[O:11])[c:5]2[cH:6][cH:7][cH:8][cH:9][c:10]21

Participants

4

Reactant 3

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 58074352Ethyl 4-(1,3-dioxoisoindolin-2-yl)-1-methylcyclohexanecarboxylate

Product 1

HCID 580743564-(1,3-Dioxoisoindolin-2-yl)-1-methylcyclohexanecarboxylic acid

Sources & evidence

ORD record
ord-dbdd90bd7d714cc4b2ba52b5a742a001
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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