Hydrochloric Acid → HCID 16412784, compound
Reaction equation
[CH3:13][O:14][c:15]1[cH:16][cH:17][c:18]([B:21]([OH:22])[OH:23])[cH:19][cH:20]1.[Cl:1][c:2]1[n:3][cH:4][c:5]([C:9]([F:10])([F:11])[F:12])[cH:6][c:7]1[Cl:8].[ClH:29].[Na+:24].[O:30]1[CH2:31][CH2:32][CH2:33][CH2:34]1.[OH2:35].[OH:25][C:26](=[O:27])[O-:28].[cH:36]1[cH:37][cH:38][c:39]([P:40]([Pd:41]([P:42]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)([c:49]2[cH:50][cH:51][cH:52][cH:53][cH:54]2)[c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)([c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[P:80]([c:81]2[cH:82][cH:83][cH:84][cH:85][cH:86]2)([c:87]2[cH:88][cH:89][cH:90][cH:91][cH:92]2)[c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)[cH:111][cH:112]1>>[c:2]1(-[c:18]2[cH:17][cH:16][c:15]([O:14][CH3:13])[cH:20][cH:19]2)[n:3][cH:4][c:5]([C:9]([F:10])([F:11])[F:12])[cH:6][c:7]1[Cl:8]Participants
9
Sources & evidence
- ORD record
- ord-bf7f09a4c18d464ea4164dc533d7b148
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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