1-Ethynyl-4-fluorobenzene → HCID 70003786, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:17](=[O:18])[O-:19])[cH:10][c:11]([I:16])[c:12]([CH2:14][OH:15])[cH:13]1)=[O:20].[F:21][c:22]1[cH:23][cH:24][c:25]([C:28]#[CH:29])[cH:26][cH:27]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][c:8]1[c:9]([N+:17](=[O:18])[O-:19])[cH:10][c:11]([C:29]#[C:28][c:25]2[cH:24][cH:23][c:22]([F:21])[cH:27][cH:26]2)[c:12]([CH2:14][OH:15])[cH:13]1)=[O:20]Participants
3
Sources & evidence
- ORD record
- ord-49cd3e8fd86c4a59856502e58c965125
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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