Bromide ion → HCID 19024734, compound
Reaction equation
[Br-:78].[CH2:1]([c:2]1[cH:3][cH:4][c:5]([CH:6]([c:7]2[cH:8][cH:9][c:10]([CH2:11][CH:12]([CH3:13])[CH3:14])[cH:15][cH:16]2)[CH2:17][c:18]2[cH:19][c:20]([C:24]([OH:25])=[O:26])[cH:21][cH:22][cH:23]2)[cH:27][cH:28]1)[CH:29]([CH3:30])[CH3:31].[CH2:32]([CH:33]([CH3:34])[CH3:35])[c:36]1[cH:37][cH:38][c:39]([CH:42]([CH2:43][c:44]2[cH:45][c:46]([C:47](=[O:48])[Cl:49])[cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][c:56]([CH2:59][CH:60]([CH3:61])[CH3:62])[cH:57][cH:58]2)[cH:40][cH:41]1.[CH3:79][Mg+:80].[CH3:86][CH2:87][O:88][C:89](=[O:90])[CH3:91].[Cl:63][C:64]([C:65]([Cl:66])=[O:67])=[O:68].[O:81]1[CH2:82][CH2:83][CH2:84][CH2:85]1.[nH:69]1[cH:70][cH:71][c:72]2[cH:73][cH:74][cH:75][cH:76][c:77]12>>[CH2:32]([CH:33]([CH3:34])[CH3:35])[c:36]1[cH:37][cH:38][c:39]([CH:42]([CH2:43][c:44]2[cH:45][c:46]([C:47](=[O:48])[c:71]3[cH:70][nH:69][c:77]4[c:72]3[cH:73][cH:74][cH:75][cH:76]4)[cH:50][cH:51][cH:52]2)[c:53]2[cH:54][cH:55][c:56]([CH2:59][CH:60]([CH3:61])[CH3:62])[cH:57][cH:58]2)[cH:40][cH:41]1Participants
9
Sources & evidence
- ORD record
- ord-c7c0b7fc6db04899a965480cba823749
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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