Acetic Acid → HCID 66854377, compound
Reaction equation
[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:45][C:46](=[O:47])[OH:48].[CH3:9][Si:10]([N-:11][Si:12]([CH3:13])([CH3:14])[CH3:15])([CH3:16])[CH3:17].[Cl:18][c:19]1[n:20][c:21](-[n:31]2[c:32]([CH:42]([F:43])[F:44])[n:33][c:34]3[c:35]2[cH:36][cH:37][cH:38][c:39]3[O:40][CH3:41])[n:22][c:23]([N:25]2[CH2:26][CH2:27][O:28][CH2:29][CH2:30]2)[n:24]1.[NH2:1][c:2]1[n:3][cH:4][n:5][cH:6][cH:7]1.[Na+:8].[OH2:54]>>[NH:1]([c:2]1[n:3][cH:4][n:5][cH:6][cH:7]1)[c:19]1[n:20][c:21](-[n:31]2[c:32]([CH:42]([F:43])[F:44])[n:33][c:34]3[c:35]2[cH:36][cH:37][cH:38][c:39]3[O:40][CH3:41])[n:22][c:23]([N:25]2[CH2:26][CH2:27][O:28][CH2:29][CH2:30]2)[n:24]1Participants
8
Sources & evidence
- ORD record
- ord-f712a3805e9d4ad8b8af5ce73a94982b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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