Ethyl bromoacetate → Ethyl 3-(3,5-bis(trifluoromethyl)phenyl)-3-cyanopropanoate
Reaction equation
[Br:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34].[CH3:18][SiH:19]([CH3:20])[N:21]([CH3:22])[Si:23]([CH3:24])([CH3:25])[CH3:26].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:13][C:14]#[N:15])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:16])[F:17].[Na:27].[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH:13]([C:14]#[N:15])[CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[cH:6][c:7]([C:9]([F:10])([F:11])[F:12])[cH:8]1)([F:16])[F:17]Participants
6
Sources & evidence
- ORD record
- ord-c6ac7c90bf0d4f888ac8c6000af15d57
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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