Ethyl 2-(4-hydroxy-2-methylphenoxy)-2-methylpropanoate → HCID 67072101, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[c:10]([CH3:16])[cH:11][c:12]([OH:15])[cH:13][cH:14]1)=[O:17].[Cl:18][CH2:19][c:20]1[c:21]([CH2:36][CH2:37][O:38][CH3:39])[n:22][c:23](-[c:26]2[cH:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]2)[n:24][cH:25]1>>[CH2:1]([CH3:2])[O:3][C:4]([C:5]([CH3:6])([CH3:7])[O:8][c:9]1[c:10]([CH3:16])[cH:11][c:12]([O:15][CH2:19][c:20]2[c:21]([CH2:36][CH2:37][O:38][CH3:39])[n:22][c:23](-[c:26]3[cH:27][cH:28][c:29]([C:32]([F:33])([F:34])[F:35])[cH:30][cH:31]3)[n:24][cH:25]2)[cH:13][cH:14]1)=[O:17]Participants
3
Sources & evidence
- ORD record
- ord-3975443b68b844b0b6df6b21f50b1f74
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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