Hydrochloric Acid → 4-Oxobicyclo[3.2.1]oct-2-en-2-yl 2-methyl-3-methylthio-4-(pentafluoroethyl)benzoate
Reaction equation
[CH3:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][cH:8][c:9]([C:13]([C:14]([F:15])([F:16])[F:17])([F:18])[F:19])[c:10]1[S:11][CH3:12].[CH3:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[CH3:44][N:45]([c:46]1[cH:47][cH:48][n:49][cH:50][cH:51]1)[CH3:52].[CH3:53][N:54]([CH3:55])[CH:56]=[O:57].[CH:26]12[C:27](=[O:35])[CH2:28][C:29](=[O:34])[CH:30]([CH2:31][CH2:32]1)[CH2:33]2.[Cl:20][C:21]([C:22]([Cl:23])=[O:24])=[O:25].[Cl:58][CH2:59][Cl:60].[ClH:43]>>[CH3:1][c:2]1[c:3]([C:4](=[O:5])[O:6][C:27]2=[CH:28][C:29](=[O:34])[CH:30]3[CH2:31][CH2:32][CH:26]2[CH2:33]3)[cH:7][cH:8][c:9]([C:13]([C:14]([F:15])([F:16])[F:17])([F:18])[F:19])[c:10]1[S:11][CH3:12]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-1a65da8f7f7f4b0aa77a92fe9394751b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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