Dichloromethane → Trifluoroacetic acid

HRID 1127762Notes

Reaction equation

HRID 1127762 reaction equation
[C:1]([O:2][C:3]([CH3:4])([CH3:5])[CH3:6])(=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][N:19]([S:22](=[O:23])(=[O:24])[c:25]3[cH:26][c:27]4[cH:28][cH:29][c:30]([Cl:35])[cH:31][c:32]4[cH:33][cH:34]3)[CH2:20][CH2:21]2)[CH2:12][CH2:13]1.[CH3:36][O:37][c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1.[Cl:51][CH2:52][Cl:53].[F:44][C:45]([C:46](=[O:47])[OH:48])([F:49])[F:50]>>[F:44][C:45]([C:46](=[O:47])[OH:48])([F:49])[F:50].[NH:8]1[CH2:9][CH2:10][CH:11]([C:14](=[O:15])[N:16]2[CH2:17][CH2:18][N:19]([S:22](=[O:23])(=[O:24])[c:25]3[cH:26][c:27]4[cH:28][cH:29][c:30]([Cl:35])[cH:31][c:32]4[cH:33][cH:34]3)[CH2:20][CH2:21]2)[CH2:12][CH2:13]1

Participants

6

Reactant 4

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 7519AnisoleHCID 121120201-(t-Butoxycarbonyl)4-(1-(6-chloronaphth-2-ylsulphonyl)piperazin-4-ylcarbonyl)piperidine

Product 2

HCID 6422Trifluoroacetic acidHCID 121120194-(1-(6-Chloronaphth-2-ylsulphonyl)piperazin-4-ylcarbonyl)piperidine

Sources & evidence

ORD record
ord-f9da25f5c957469099007174a9ed8bd7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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