Acetic Acid → HCID 72325698, compound
Reaction equation
[BH4-:24].[CH3:20][C:21](=[O:22])[OH:23].[CH3:27][C:28]#[N:29].[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([N:10]2[CH:11]([CH:17]([CH3:18])[CH3:19])[C:12]([OH:16])=[CH:13][C:14]2=[O:15])[cH:9]1.[Na+:25].[OH2:26]>>[Cl:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([N:10]2[CH:11]([CH:17]([CH3:18])[CH3:19])[CH:12]([OH:16])[CH2:13][C:14]2=[O:15])[cH:9]1Participants
7
Sources & evidence
- ORD record
- ord-245a68fe6f8c4ad4a4df5c99c5af638f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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