Tetrahydrofuran → 2-Fluoro-4-(isothiazol-4-ylmethoxy)benzonitrile

HRID 1125736Notes

Reaction equation

HRID 1125736 reaction equation
[F:41][c:42]1[c:43]([C:44]#[N:45])[cH:46][cH:47][c:48]([OH:50])[cH:49]1.[O:1]=[C:2]([O:3][CH:4]([CH3:5])[CH3:6])[N:7]=[N:8][C:9]([O:10][CH:11]([CH3:12])[CH3:13])=[O:14].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[c:15]1([P:16]([c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[cH:29][cH:30][cH:31][cH:32][cH:33]1.[s:34]1[n:35][cH:36][c:37]([CH2:39][OH:40])[cH:38]1>>[s:34]1[n:35][cH:36][c:37]([CH2:39][O:40][c:48]2[cH:47][cH:46][c:43]([C:44]#[N:45])[c:42]([F:41])[cH:49]2)[cH:38]1

Participants

6

Reactant 5

HCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 75555Diisopropyl diazene-1,2-dicarboxylateHCID 27346752-Fluoro-4-hydroxybenzonitrileHCID 22010122(1,2-Thiazol-4-yl)methanol

Product 1

HCID 220102302-Fluoro-4-(isothiazol-4-ylmethoxy)benzonitrile

Sources & evidence

ORD record
ord-55b3e535de2944eeafb8095fc0c0537c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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