Formaldehyde → HCID 21093729, compound
Reaction equation
[C:36]([O:37][BH-:38]([O:39][C:40](=[O:41])[CH3:42])[O:43][C:44](=[O:45])[CH3:46])(=[O:47])[CH3:48].[CH2:50]=[O:51].[Cl:52][CH:53]([Cl:54])[CH3:55].[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:35]1)[NH:7][c:8]1[s:9][c:10]3[c:11]([c:12]1[C:13]([N:15]1[CH2:16][CH:17]([CH2:21][CH2:22][c:23]4[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][cH:28]4)[NH:18][CH2:19][CH2:20]1)=[N:14]2)[cH:31][cH:32][cH:33][cH:34]3.[Na+:49]>>[F:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:35]1)[NH:7][c:8]1[s:9][c:10]3[c:11]([c:12]1[C:13]([N:15]1[CH2:16][CH:17]([CH2:21][CH2:22][c:23]4[cH:24][c:25]([O:29][CH3:30])[cH:26][cH:27][cH:28]4)[N:18]([CH3:36])[CH2:19][CH2:20]1)=[N:14]2)[cH:31][cH:32][cH:33][cH:34]3Participants
6
Sources & evidence
- ORD record
- ord-90e5ccd04c1a4d25a6118b98dceec727
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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