3-Pyridinemethanol → Trifluoroacetic acid

HRID 2339148Notes

Reaction equation

HRID 2339148 reaction equation
[Br:1][c:2]1[cH:3][c:4](-[n:9]2[c:10](-[c:15]3[c:16]([NH:20][C:21]([C:22]([F:23])([F:24])[F:25])=[O:26])[n:17][o:18][n:19]3)[n:11][o:12][c:13]2=[O:14])[cH:5][cH:6][c:7]1[F:8].[CH2:27]([c:28]1[cH:29][n:30][cH:31][cH:32][cH:33]1)[OH:34].[O:54]=[C:55]([O:56][CH:57]([CH3:58])[CH3:59])[N:60]=[N:61][C:62]([O:63][CH:64]([CH3:65])[CH3:66])=[O:67].[O:68]1[CH2:69][CH2:70][CH2:71][CH2:72]1.[c:35]1([P:36]([c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[cH:49][cH:50][cH:51][cH:52][cH:53]1>>[Br:1][c:2]1[cH:3][c:4](-[n:9]2[c:10](-[c:15]3[c:16]([NH:20][CH2:27][c:28]4[cH:29][n:30][cH:31][cH:32][cH:33]4)[n:17][o:18][n:19]3)[n:11][o:12][c:13]2=[O:14])[cH:5][cH:6][c:7]1[F:8].[C:21]([C:22]([F:23])([F:24])[F:25])([OH:26])=[O:34]

Participants

7

Reactant 5

HCID 75103-PyridinemethanolHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 58755133N-[4-[4-(3-Bromo-4-fluorophenyl)-5-oxo-4,5-dihydro-1,2,4-oxadiazol-3-yl]-1,2,5-oxadiazol-3-yl]-2,2,2-trifluoroacetamide

Product 2

HCID 6422Trifluoroacetic acidHCID 58558294HCID 58558294, compound

Sources & evidence

ORD record
ord-7209917122df4e378db2e1c6fe6c3682
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…