Ethanol → HCID 19030106, compound
Reaction equation
[CH3:29][CH2:30][OH:31].[Cl:1][c:2]1[cH:3][c:4]([N+:26]([O-:27])=[O:28])[cH:5][c:6]([Cl:25])[c:7]1[O:8][c:9]1[cH:10][c:11]([CH2:17][c:18]2[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]2)[c:12]([O:15][CH3:16])[cH:13][cH:14]1>>[Cl:1][c:2]1[cH:3][c:4]([NH2:26])[cH:5][c:6]([Cl:25])[c:7]1[O:8][c:9]1[cH:10][c:11]([CH2:17][c:18]2[cH:19][cH:20][c:21]([F:24])[cH:22][cH:23]2)[c:12]([O:15][CH3:16])[cH:13][cH:14]1Participants
3
Sources & evidence
- ORD record
- ord-ce689679cfb44fb19d7fd8aa3cdd16fe
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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