Hydrochloric Acid → Hydrochloric Acid
Reaction equation
[C:36](=[O:37])([O-:38])[O-:39].[CH3:78][CH2:79][OH:80].[CH3:81][C:82]#[N:83].[Cl:2][c:3]1[cH:4][c:5]([N:6]2[CH2:7][CH2:8][N:9]([CH2:10][CH2:11][CH2:12][n:13]3[c:14]([CH2:15][CH3:16])[n:17][nH:18][c:19]3=[O:20])[CH2:21][CH2:22]2)[cH:23][cH:24][cH:25]1.[Cl:44][c:45]1[cH:46][c:47]([N:51]2[CH2:52][CH2:53][N:54]([CH2:57][CH2:58][CH2:59][n:60]3[c:61](=[O:76])[n:62]([CH2:67][CH2:68][O:69][c:70]4[cH:71][cH:72][cH:73][cH:74][cH:75]4)[n:63][c:64]3[CH2:65][CH3:66])[CH2:55][CH2:56]2)[cH:48][cH:49][cH:50]1.[ClH:1].[ClH:77].[I-:43].[K+:40].[K+:41].[K+:42].[O:26]([CH2:27][CH2:28][Br:29])[c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[Cl:44][c:45]1[cH:46][c:47]([N:51]2[CH2:52][CH2:53][N:54]([CH2:57][CH2:58][CH2:59][n:60]3[c:61](=[O:76])[n:62]([CH2:67][CH2:68][O:69][c:70]4[cH:71][cH:72][cH:73][cH:74][cH:75]4)[n:63][c:64]3[CH2:65][CH3:66])[CH2:55][CH2:56]2)[cH:48][cH:49][cH:50]1.[ClH:2]Participants
11
Reactant 9
Product 2
Sources & evidence
- ORD record
- ord-f6a5f4afe47e4668ab888d2002f5ffc5
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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