Acetic Acid → HCID 22603068, compound

HRID 125186Notes

Reaction equation

HRID 125186 reaction equation
[CH3:30][C:31](=[O:32])[OH:33].[ClH:28].[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[cH:9][cH:10][c:11]3[cH:12][c:13]([C:17](=[O:18])[NH:19][CH3:20])[cH:14][cH:15][c:16]23)[cH:6][cH:7]1.[NH:21]1[CH2:22][CH2:23][C:24](=[O:27])[CH2:25][CH2:26]1.[OH2:29].[OH:34][C:35]([C:36]([F:37])([F:38])[F:39])=[O:40]>>[F:1][c:2]1[cH:3][cH:4][c:5](-[n:8]2[cH:9][c:10]([C:24]3=[CH:23][CH2:22][NH:21][CH2:26][CH2:25]3)[c:11]3[cH:12][c:13]([C:17](=[O:18])[NH:19][CH3:20])[cH:14][cH:15][c:16]23)[cH:6][cH:7]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 962WaterHCID 6422Trifluoroacetic acidHCID 337214-PiperidoneHCID 22603069HCID 22603069, compound

Product 1

HCID 22603068HCID 22603068, compound

Sources & evidence

ORD record
ord-5a9df6036d264915aa5cb5159878b1a2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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