Acetonitrile → Hexyl isocyanate
Reaction equation
[Br:1][CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH3:7].[CH3:11][N:12]([S+:13]([N:14]([CH3:15])[CH3:16])[N:17]([CH3:18])[CH3:19])[CH3:20].[CH3:21][C:22]#[N:23].[O-:8][C:9]#[N:10]>>[CH2:2]([CH2:3][CH2:4][CH2:5][CH2:6][CH3:7])[N:10]=[C:9]=[O:8]Participants
5
Sources & evidence
- ORD record
- ord-4e3d186829454948ae57be32834feb32
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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