1,4-Dioxane → HCID 23077584, compound
Reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10](=[O:30])[c:11]([Br:29])[cH:12][n:13]2[c:14]1[C:15](=[O:28])[N:16]([CH2:19][c:20]1[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]1)[CH2:17][CH2:18]2.[O:65]1[CH2:66][CH2:67][O:68][CH2:69][CH2:70]1.[o:31]1[cH:32][cH:33][cH:34][c:35]1[P:36]([c:37]1[o:38][cH:39][cH:40][cH:41]1)[c:42]1[o:43][cH:44][cH:45][cH:46]1.[s:47]1[c:48]([Sn:52]([CH2:53][CH2:54][CH2:55][CH3:56])([CH2:57][CH2:58][CH2:59][CH3:60])[CH2:61][CH2:62][CH2:63][CH3:64])[n:49][cH:50][cH:51]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10](=[O:30])[c:11](-[c:48]2[s:47][cH:51][cH:50][n:49]2)[cH:12][n:13]2[c:14]1[C:15](=[O:28])[N:16]([CH2:19][c:20]1[cH:21][c:22]([Cl:27])[c:23]([Cl:26])[cH:24][cH:25]1)[CH2:17][CH2:18]2Participants
5
Sources & evidence
- ORD record
- ord-2c46a1ef73a042c3a788d70368eb4742
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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