(alpha,alpha,alpha-Trifluoro-4-tolyl)acetic acid → HCID 68750749, compound
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH2:14])[n:7][n:8]2[c:9]1[n:10][cH:11][cH:12][cH:13]2.[F:15][C:16]([c:17]1[cH:18][cH:19][c:20]([CH2:23][C:24](=[O:25])[OH:26])[cH:21][cH:22]1)([F:27])[F:28]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[c:6]([NH:14][C:24]([CH2:23][c:20]2[cH:19][cH:18][c:17]([C:16]([F:15])([F:27])[F:28])[cH:22][cH:21]2)=[O:25])[n:7][n:8]2[c:9]1[n:10][cH:11][cH:12][cH:13]2Participants
3
Sources & evidence
- ORD record
- ord-90392c91067245069bd6f3c22f381a08
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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