Trifluoroacetic acid → HCID 178440961, compound
Reaction equation
[Br:30][c:31]1[cH:32][c:33]([CH3:41])[cH:34][c:35]2[cH:36][cH:37][cH:38][cH:39][c:40]12.[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]([CH2:10][CH2:11][CH3:12])[c:13]2[cH:14][cH:15][c:16]([C:17](=[O:18])[NH:19][CH2:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:27][cH:28]2)[OH:29])[cH:6][cH:7]1.[OH:42][C:43]([C:44]([F:45])([F:46])[F:47])=[O:48]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]([CH2:10][CH2:11][CH3:12])[c:13]2[cH:14][cH:15][c:16]([C:17](=[O:18])[NH:19][CH2:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:27][cH:28]2)[c:36]2[c:35]3[cH:34][c:33]([CH3:41])[cH:32][c:31]([Br:30])[c:40]3[cH:39][cH:38][cH:37]2)[cH:6][cH:7]1Participants
4
Sources & evidence
- ORD record
- ord-f34701931efd4fc2ae02127e6ee2e821
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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