Benzene, 1,3-bis(chloromethyl)- → HCID 54511085, compound
Reaction equation
[Br:1][CH2:2][c:3]1[cH:4][c:5]([C:9]([O:10][CH3:11])=[O:12])[cH:6][cH:7][cH:8]1.[Br:23][CH2:24][c:25]1[cH:26][c:27]([CH:31]=[O:32])[cH:28][cH:29][cH:30]1.[CH2:33]([CH3:34])[N:35]([CH2:36][CH:37]=[CH:38][C:39]#[C:40][C:41]([CH3:42])([CH3:43])[CH3:44])[CH2:45][c:46]1[cH:47][c:48]([C:52]([O:53][CH3:54])=[O:55])[cH:49][cH:50][cH:51]1.[Cl:13][CH2:14][c:15]1[cH:16][c:17]([CH2:21][Cl:22])[cH:18][cH:19][cH:20]1>>[CH2:14]([c:15]1[cH:16][c:17]([CH2:21][Cl:22])[cH:18][cH:19][cH:20]1)[N:35]([CH2:33][CH3:34])[CH2:36][CH:37]=[CH:38][C:39]#[C:40][C:41]([CH3:42])([CH3:43])[CH3:44]Participants
5
Sources & evidence
- ORD record
- ord-f74bb396277f4610ac2945d9e55d7268
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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