2,2,2-Trifluoroethanol → HCID 59351535, compound
Reaction equation
[Cl:1][c:2]1[cH:3][c:4](=[O:24])[nH:5][c:6](=[O:23])[n:7]1[CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[c:16]([C:21]#[N:22])[cH:17][cH:18][cH:19][cH:20]2)[cH:13][cH:14]1.[Na:25].[OH:26][CH2:27][C:28]([F:29])([F:30])[F:31]>>[c:2]1([O:26][CH2:27][C:28]([F:29])([F:30])[F:31])[cH:3][c:4](=[O:24])[nH:5][c:6](=[O:23])[n:7]1[CH2:8][c:9]1[cH:10][cH:11][c:12](-[c:15]2[c:16]([C:21]#[N:22])[cH:17][cH:18][cH:19][cH:20]2)[cH:13][cH:14]1Participants
4
Sources & evidence
- ORD record
- ord-645a80d698be40b092808847880e1d45
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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