Water → Trifluoroacetic acid

HRID 949953Notes

Reaction equation

HRID 949953 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([CH2:7][CH:8]([CH:9]=[O:10])[NH:11][S:12](=[O:13])(=[O:14])[c:15]1[c:16]([O:21][CH2:22][CH2:23][c:24]2[cH:25][n:26][cH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]23)[cH:17][cH:18][cH:19][cH:20]1)=[O:34].[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[Cl:42][CH2:43][Cl:44].[F:35][C:36]([C:37](=[O:38])[OH:39])([F:40])[F:41].[OH2:45]>>[F:35][C:36]([C:37](=[O:38])[OH:39])([F:40])[F:41].[O:5]=[C:6]([CH2:7][CH:8]([CH:9]=[O:10])[NH:11][S:12](=[O:13])(=[O:14])[c:15]1[c:16]([O:21][CH2:22][CH2:23][c:24]2[cH:25][n:26][cH:27][c:28]3[cH:29][cH:30][cH:31][cH:32][c:33]23)[cH:17][cH:18][cH:19][cH:20]1)[OH:34]

Participants

7

Reactant 5

HCID 962WaterHCID 1140TolueneHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 87952615Tert-butyl 3-[[2-(2-isoquinolin-4-ylethoxy)phenyl]sulfonylamino]-4-oxobutanoate

Product 2

HCID 6422Trifluoroacetic acidHCID 225039933-[[2-(2-Isoquinolin-4-ylethoxy)phenyl]sulfonylamino]-4-oxobutanoic acid

Sources & evidence

ORD record
ord-c28775605c72435e985a9e64f8da51d5
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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