Propanoic acid, 2-bromo-2-methyl-, ethyl ester → HCID 53680788, compound
Reaction equation
[CH2:1]([CH3:2])[n:3]1[c:4]([CH3:19])[c:5](-[c:13]2[cH:14][cH:15][n:16][cH:17][cH:18]2)[c:6]2[cH:7][c:8]([OH:12])[cH:9][cH:10][c:11]12.[CH2:20]([CH3:21])[O:22][C:23]([C:24]([CH3:25])([CH3:26])[Br:27])=[O:28]>>[CH2:1]([CH3:2])[n:3]1[c:4]([CH3:19])[c:5](-[c:13]2[cH:14][cH:15][n:16][cH:17][cH:18]2)[c:6]2[cH:7][c:8]([O:12][C:24]([C:23]([O:22][CH2:20][CH3:21])=[O:28])([CH3:25])[CH3:26])[cH:9][cH:10][c:11]12Participants
3
Sources & evidence
- ORD record
- ord-91a44b4a08c1407c8da2be5704fca7bc
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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