3-Fluorobenzoic Acid → HCID 59401834, compound
Reaction equation
[CH3:1][c:2]1[c:3]([NH2:19])[cH:4][cH:5][c:6]([N:8]2[CH2:9][CH:10]([N:13]3[CH:14]([CH3:18])[CH2:15][CH2:16][CH2:17]3)[CH2:11][CH2:12]2)[cH:7]1.[F:20][c:21]1[cH:22][c:23]([C:24](=[O:25])[OH:26])[cH:27][cH:28][cH:29]1>>[CH3:1][c:2]1[c:3]([NH:19][C:24]([c:23]2[cH:22][c:21]([F:20])[cH:29][cH:28][cH:27]2)=[O:25])[cH:4][cH:5][c:6]([N:8]2[CH2:9][CH:10]([N:13]3[CH:14]([CH3:18])[CH2:15][CH2:16][CH2:17]3)[CH2:11][CH2:12]2)[cH:7]1Participants
3
Sources & evidence
- ORD record
- ord-8b378cb1e6ac44dea1fd80c16bfb8927
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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