Hydrochloric Acid → HCID 22344545, compound
Reaction equation
[CH2:21]([CH3:22])[O:23][c:24]1[cH:25][cH:26][c:27]([B:30]([OH:31])[OH:32])[cH:28][cH:29]1.[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:20])[c:7]1[C:8]1=[N:12][CH:11]([c:13]2[cH:14][cH:15][c:16]([I:19])[cH:17][cH:18]2)[CH2:10][O:9]1.[ClH:61].[Na+:33].[Na+:34].[O-:35][C:36](=[O:37])[O-:38].[Pd:62]([Cl:63])[Cl:64].[c:39]1([CH3:40])[cH:41][cH:42][cH:43][cH:44][c:45]1[P:46]([c:47]1[cH:48][cH:49][cH:50][cH:51][c:52]1[CH3:53])[c:54]1[cH:55][cH:56][cH:57][cH:58][c:59]1[CH3:60].[c:65]1([P:66]([c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)[c:73]2[cH:74][cH:75][cH:76][cH:77][cH:78]2)[cH:79][cH:80][cH:81][cH:82][cH:83]1.[c:84]1([P:85]([c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[c:92]2[cH:93][cH:94][cH:95][cH:96][cH:97]2)[cH:98][cH:99][cH:100][cH:101][cH:102]1>>[Cl:1][c:2]1[cH:3][n:4][cH:5][c:6]([Cl:20])[c:7]1[C:8]1=[N:12][CH:11]([c:13]2[cH:14][cH:15][c:16](-[c:27]3[cH:26][cH:25][c:24]([O:23][CH2:21][CH3:22])[cH:29][cH:28]3)[cH:17][cH:18]2)[CH2:10][O:9]1Participants
9
Sources & evidence
- ORD record
- ord-67b8ee746e3c47cc852731c45c88658f
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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