Dichloromethane → Nonanoic Acid
Reaction equation
[C:16]([CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])(=[O:25])[OH:26].[CH2:27]1[CH2:28][CH2:29][CH2:30][CH2:31]1.[CH2:32]([CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[c:40]1[cH:41][n:42][c:43](-[c:46]2[cH:47][cH:48][c:49]([OH:52])[cH:50][cH:51]2)[n:44][cH:45]1.[CH3:56][N:57]([CH3:58])[c:59]1[cH:60][cH:61][n:62][cH:63][cH:64]1.[CH:1]1([N:2]=[C:3]=[N:4][CH:5]2[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]2)[CH2:11][CH2:12][CH2:13][CH2:14][CH2:15]1.[Cl:53][CH2:54][Cl:55]>>[C:16]([CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH3:24])(=[O:25])[OH:26].[CH:27]1([c:49]2[cH:48][cH:47][c:46](-[c:43]3[n:42][cH:41][c:40]([CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39])[cH:45][n:44]3)[cH:51][cH:50]2)[CH2:28][CH2:29][CH2:30][CH2:31]1Participants
8
Sources & evidence
- ORD record
- ord-9a3023dd24fd4be6b6bacef430f40c28
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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