Acetic Acid → 1-benzyl-N,N-dimethyl-N'-propylcyclohexane-1,4-diamine
Reaction equation
[C:22]([O:23][BH-:24]([O:25][C:26](=[O:27])[CH3:28])[O:29][C:30](=[O:31])[CH3:32])(=[O:33])[CH3:34].[CH2:18]([CH2:19][CH3:20])[NH2:21].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[C:8]1([N:15]([CH3:16])[CH3:17])[CH2:9][CH2:10][C:11](=[O:14])[CH2:12][CH2:13]1.[CH3:43][C:44](=[O:45])[OH:46].[Na+:35].[Na+:37].[O:38]1[CH2:39][CH2:40][CH2:41][CH2:42]1.[OH-:36]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[C:8]1([N:15]([CH3:16])[CH3:17])[CH2:9][CH2:10][CH:11]([NH:21][CH2:18][CH2:19][CH3:20])[CH2:12][CH2:13]1Participants
8
Sources & evidence
- ORD record
- ord-319e970ae07144769b9a6ddc0142ed74
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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