1-Bromo-5-chloropentane → HCID 21868854, compound
Reaction equation
[Br:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][Cl:45].[O:1]1[CH:2]([O:7][c:8]2[cH:9][cH:10][c:11]3[c:12]([cH:38]2)[CH2:13][CH2:14][CH2:15][C:16]([c:25]2[cH:26][cH:27][c:28]([O:31][CH:32]4[O:33][CH2:34][CH2:35][CH2:36][CH2:37]4)[cH:29][cH:30]2)=[C:17]3[c:18]2[cH:19][cH:20][c:21]([OH:24])[cH:22][cH:23]2)[CH2:3][CH2:4][CH2:5][CH2:6]1>>[O:1]1[CH:2]([O:7][c:8]2[cH:9][cH:10][c:11]3[c:12]([cH:38]2)[CH2:13][CH2:14][CH2:15][C:16]([c:25]2[cH:26][cH:27][c:28]([O:31][CH:32]4[O:33][CH2:34][CH2:35][CH2:36][CH2:37]4)[cH:29][cH:30]2)=[C:17]3[c:18]2[cH:19][cH:20][c:21]([O:24][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][Cl:45])[cH:22][cH:23]2)[CH2:3][CH2:4][CH2:5][CH2:6]1Participants
3
Sources & evidence
- ORD record
- ord-afb93b0378b249449f961a72854ef624
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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