Hydrochloric Acid → N-[1-Phenyl-4-oxocyclohexyl]-2-[3,5-bis(trifluoromethyl)phenyl]propionamide

HRID 169880Notes

Reaction equation

HRID 169880 reaction equation
[CH3:1][CH:2]([C:3](=[O:4])[OH:5])[c:6]1[cH:7][c:8]([C:16]([F:17])([F:18])[F:19])[cH:9][c:10]([C:12]([F:13])([F:14])[F:15])[cH:11]1.[CH3:35][CH2:36][CH2:37][CH:38]([CH3:39])[CH3:40].[CH3:41][CH2:42][OH:43].[ClH:20].[O:21]=[C:22]1[CH2:23][CH2:24][C:25]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)([NH2:34])[CH2:26][CH2:27]1>>[CH3:1][CH:2]([C:3](=[O:4])[NH:34][C:25]1([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[CH2:24][CH2:23][C:22](=[O:21])[CH2:27][CH2:26]1)[c:6]1[cH:7][c:8]([C:16]([F:17])([F:18])[F:19])[cH:9][c:10]([C:12]([F:13])([F:14])[F:15])[cH:11]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 702EthanolHCID 78922-MethylpentaneHCID 115220582-(3,5-Bis(trifluoromethyl)phenyl)propanoic acidHCID 204533024-Amino-4-phenylcyclohexan-1-one

Product 1

HCID 21955177N-[1-Phenyl-4-oxocyclohexyl]-2-[3,5-bis(trifluoromethyl)phenyl]propionamide

Sources & evidence

ORD record
ord-e95b587867ae4331a5465667d67d78c3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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