4-Isopropylaniline → HCID 24889263, compound
Reaction equation
[CH:25]([c:26]1[cH:27][cH:28][c:29]([NH2:30])[cH:31][cH:32]1)([CH3:33])[CH3:34].[CH:35]([CH3:36])([CH3:37])[c:38]1[cH:39][cH:40][c:41]([N:44]2[CH2:45][CH2:46][c:47]3[c:48]2[n:49][c:50]([N:61]2[CH2:62][CH2:63][O:64][CH2:65][CH2:66]2)[n:51][c:52]3-[c:53]2[cH:54][c:55]([O:59][CH3:60])[cH:56][cH:57][cH:58]2)[cH:42][cH:43]1.[Cl:1][c:2]1[c:3]([CH2:4][CH2:5][Cl:6])[c:7](-[c:8]2[cH:9][cH:10][cH:11][c:12]([O:13][CH3:14])[cH:15]2)[n:16][c:17]([N:18]2[CH2:19][CH2:20][O:21][CH2:22][CH2:23]2)[n:24]1>>[CH:35]([CH3:36])([CH3:37])[c:38]1[cH:39][cH:40][c:41]([N:44]2[CH2:45][CH2:46][c:47]3[c:48]2[n:49][c:50]([N:61]2[CH2:62][CH2:63][O:64][CH2:65][CH2:66]2)[n:51][c:52]3-[c:53]2[cH:54][c:55]([OH:59])[cH:56][cH:57][cH:58]2)[cH:42][cH:43]1Participants
4
Sources & evidence
- ORD record
- ord-3dfa39a0d606400f81a17d27ceff4d3f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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