Ethanol → HCID 22418310, compound
Reaction equation
[BH4-:30].[CH3:32][CH2:33][OH:34].[Cl:1][c:2]1[c:3](-[n:13]2[c:14]([CH:26]=[CH:27][C:28]#[N:29])[c:15]([S:21][C:22]([F:23])([F:24])[F:25])[c:16]([C:19]#[N:20])[c:17]2[Cl:18])[c:4]([Cl:12])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1.[Na+:31]>>[Cl:1][c:2]1[c:3](-[n:13]2[c:14]([CH2:26][CH2:27][C:28]#[N:29])[c:15]([S:21][C:22]([F:23])([F:24])[F:25])[c:16]([C:19]#[N:20])[c:17]2[Cl:18])[c:4]([Cl:12])[cH:5][c:6]([C:8]([F:9])([F:10])[F:11])[cH:7]1Participants
5
Sources & evidence
- ORD record
- ord-af1504aa0a40456bb0847a7dae419fcf
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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