Chloride → [Cyclohexyl(hydroxy)methylidene]propanedinitrile
Reaction equation
[CH:9]1([C:15](=[O:16])[OH:17])[CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]1.[Cl-:8].[ClH:18].[H-:6].[N:1]#[C:2][CH2:3][C:4]#[N:5].[Na+:7].[O:19]1[CH2:20][CH2:21][CH2:22][CH2:23]1>>[N:1]#[C:2][C:3]([C:4]#[N:5])=[C:15]([CH:9]1[CH2:10][CH2:11][CH2:12][CH2:13][CH2:14]1)[OH:16]Participants
8
Sources & evidence
- ORD record
- ord-176b3d93953b456aad5ce7cffe1347f2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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