Calcium Cation → 4-Amino-5-fluoro-7-iodo-1,3-benzodioxole
Reaction equation
[CH2:20]([N+:21]([CH3:22])([CH3:23])[CH3:24])[c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[CH3:39][OH:40].[Ca+2:31].[Cl:36][CH2:37][Cl:38].[F:1][c:2]1[c:3]([NH2:11])[c:4]2[c:5]([cH:9][cH:10]1)[O:6][CH2:7][O:8]2.[I:12]([Cl:13])(=[O:14])=[O:15].[I:16]([Cl:17])(=[O:18])=[O:19].[O-:32][C:33](=[O:34])[O-:35]>>[F:1][c:2]1[c:3]([NH2:11])[c:4]2[c:5]([c:9]([I:12])[cH:10]1)[O:6][CH2:7][O:8]2Participants
8
Sources & evidence
- ORD record
- ord-a96779f02e394119bb14f3fc083ba22b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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